data_2eq4_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 2eq4 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 N--CA 1.458 -0.049 0 CA-C-O 120.854 0.359 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.43 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.86 0.362 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.432 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.878 0.371 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.907 0.384 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.428 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.428 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.88 0.372 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.425 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.888 0.375 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.431 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.917 0.389 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.43 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.893 0.378 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.426 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.432 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.892 0.377 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.434 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 . . . . . 0 N--CA 1.458 -0.047 0 CA-C-O 120.886 0.375 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.423 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.846 0.355 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.429 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.9 0.381 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.423 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.891 0.377 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.428 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.428 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.882 0.373 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.414 ' CB ' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ALA . . . . . 0.434 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.432 -0.267 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.7 m -109.73 53.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.891 0.377 . . . . 0.0 110.873 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 28.4 p -77.78 122.88 26.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -177.08 98.1 0.12 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 47.6 t -101.89 114.29 28.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 110.868 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 10.3 m -83.61 109.9 17.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.824 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 150.34 -163.7 29.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.488 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.1 t -118.59 -31.55 4.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 0.0 111.146 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -106.02 101.11 1.76 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.485 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -81.48 79.05 8.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.895 0.379 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.52 141.32 39.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.901 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.07 110.99 17.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.956 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -67.3 124.49 23.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.43 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -76.19 75.42 3.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -106.41 74.61 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 61.07 -132.9 49.05 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.526 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -140.12 140.33 36.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.874 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.36 73.31 0.74 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.632 0.73 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 86.67 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 2.264 . . . . 0.0 112.331 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -89.07 95.18 10.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.822 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -58.75 -179.16 1.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.517 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -31.89 19.42 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.718 2.279 . . . . 0.0 112.305 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 t 53.11 51.9 14.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.86 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.4 m -82.12 170.02 15.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.157 -0.802 . . . . 0.0 112.448 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.9 m -67.32 135.11 52.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.862 0.363 . . . . 0.0 110.872 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 26.0 t -139.3 157.02 46.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.848 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -92.23 -152.74 29.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -143.68 167.16 22.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.884 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.1 m -100.39 112.2 24.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.86 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 162.3 -79.91 0.14 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 62.5 p -54.03 150.85 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 0.0 111.141 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 109.72 -37.31 3.84 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.445 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.8 153.72 45.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.88 0.372 . . . . 0.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -170.45 129.6 0.86 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.0 mt -137.78 113.73 9.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -65.46 121.9 15.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.432 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -67.28 123.93 21.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.2 m 52.41 33.89 13.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.833 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -59.17 -28.87 64.73 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.482 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -113.79 129.17 56.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.894 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 57.43 69.1 1.72 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.589 0.709 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -36.93 9.94 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 73.3 m -90.23 -63.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.865 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 166.08 -173.04 41.6 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.505 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 82.05 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.678 2.252 . . . . 0.0 112.369 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 3.1 t -112.89 132.35 55.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.0 t -92.63 137.28 32.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.888 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-O 119.177 -0.79 . . . . 0.0 112.445 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 14.7 t -70.55 113.3 7.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.851 0.357 . . . . 0.0 110.84 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 59.5 p -92.16 153.29 19.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -88.8 175.72 43.79 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.1 m -111.94 -175.64 2.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.831 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.5 m -95.96 127.19 41.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -142.94 34.09 1.8 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.454 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.1 m -116.28 77.46 1.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 0.0 111.128 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 98.86 141.39 12.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -102.42 56.65 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.402 . . . . 0.0 110.913 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -117.86 103.53 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 95.5 mt -145.09 107.17 4.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -117.6 119.4 34.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -68.59 -178.13 1.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 39.8 t -81.69 -66.05 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 70.69 126.11 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.485 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -102.37 -40.07 6.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -118.76 71.31 10.21 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.555 0.693 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -21.22 33.9 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.681 2.254 . . . . 0.0 112.385 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.68 50.59 10.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -100.88 166.6 19.28 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 158.98 55.15 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.676 2.251 . . . . 0.0 112.353 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 19.1 m -99.42 -42.76 6.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.9 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.0 t -90.66 106.04 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.378 0 CA-C-O 119.152 -0.805 . . . . 0.0 112.514 -179.985 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 88.6 p -125.55 119.57 28.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.83 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.0 t -79.27 97.94 6.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 133.77 98.76 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 10.4 p -117.0 -64.37 1.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.6 t -158.71 113.2 2.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.885 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.35 118.28 4.86 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 70.9 p -122.68 30.04 6.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.817 0.341 . . . . 0.0 111.152 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -71.5 -100.24 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.518 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -66.55 164.27 16.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.0 110.867 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.84 145.77 43.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.7 mp -108.48 97.87 7.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -71.09 132.59 45.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.428 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.428 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -58.18 104.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 72.2 m -95.99 173.26 7.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.897 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -100.11 78.99 0.46 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.03 93.96 3.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.922 0.391 . . . . 0.0 110.912 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -132.4 72.11 78.58 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.594 0.711 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 -25.96 28.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.6 m -65.33 163.54 15.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.2 -175.0 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.494 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -17.17 37.73 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.694 2.262 . . . . 0.0 112.363 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 60.0 p -70.01 -48.76 56.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 26.6 m -108.68 124.97 51.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.868 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.506 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 40.0 p -164.92 122.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.86 0.362 . . . . 0.0 110.845 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.5 p -169.34 179.73 3.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.864 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 79.6 72.7 1.18 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.464 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 20.2 m -95.55 80.98 3.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.861 0.362 . . . . 0.0 110.86 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 23.0 t -56.11 168.23 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.823 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 136.76 159.1 8.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.529 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 34.6 p -127.13 109.95 12.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.802 0.334 . . . . 0.0 111.185 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -110.07 -39.0 1.6 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.505 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -103.31 147.37 27.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.931 0.396 . . . . 0.0 110.878 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -135.82 141.95 44.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.9 mp -127.2 122.74 34.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -67.55 118.21 10.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 -53.44 108.3 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.3 m -71.15 96.97 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -160.13 138.67 5.68 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.88 44.56 2.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.902 0.382 . . . . 0.0 110.893 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? 56.66 68.9 1.94 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -22.24 32.24 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.676 2.25 . . . . 0.0 112.327 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.2 m -91.1 131.38 36.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 77.2 168.31 29.69 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -171.43 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.705 2.27 . . . . 0.0 112.357 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 4.6 m -133.74 120.67 20.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.833 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.8 p -111.36 55.83 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 20.1 m -133.6 -68.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.894 0.378 . . . . 0.0 110.875 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 3.2 p -98.91 -54.93 2.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -159.35 105.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.476 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 3.6 m -76.18 176.15 8.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.862 0.363 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 57.0 m -77.2 107.7 9.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -98.47 -172.16 32.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.486 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.9 m -79.86 137.43 36.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -89.23 142.87 17.05 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.497 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -118.2 163.7 16.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.906 0.384 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -79.38 142.17 36.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.1 mp -111.94 93.26 4.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.957 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -73.28 125.72 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -53.03 125.31 16.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 75.4 m -158.28 173.63 16.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.8 84.48 0.12 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.478 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -72.54 -40.23 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.942 0.401 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? 52.73 71.39 1.46 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.693 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -19.3 36.14 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.675 2.25 . . . . 0.0 112.354 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 50.7 m -97.38 51.52 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.814 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 58.34 177.87 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.48 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 179.52 3.66 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.642 2.228 . . . . 0.0 112.331 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 20.0 t -89.09 94.55 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 11.8 p -62.9 138.36 58.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 CA-C-O 119.143 -0.81 . . . . 0.0 112.496 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.9 m -110.13 104.39 13.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.375 . . . . 0.0 110.863 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.8 p -123.31 162.36 22.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.856 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -163.75 114.4 0.6 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.49 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 57.8 m -93.83 56.17 2.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.906 0.384 . . . . 0.0 110.856 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 p -79.36 173.23 12.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.834 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 92.43 71.28 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.493 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.7 t -158.36 161.36 37.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.139 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 143.22 103.15 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.448 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -139.06 177.54 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.938 0.399 . . . . 0.0 110.847 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -152.36 138.56 18.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 62.2 mt -152.75 116.8 4.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -61.36 118.26 6.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.96 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.425 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 -66.04 -178.55 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.8 t -113.07 159.27 19.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.795 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.78 -65.42 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -78.85 149.59 32.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -114.85 71.9 2.69 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.547 0.689 . . . . 0.0 110.869 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -175.08 1.04 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 0.0 112.317 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 79.5 p -121.55 -34.49 3.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 105.66 169.47 23.56 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 106.4 1.66 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.681 2.254 . . . . 0.0 112.313 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 85.2 p -133.95 144.32 48.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.6 t -102.45 89.57 3.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 CA-C-O 119.141 -0.811 . . . . 0.0 112.433 -179.941 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.6 m -132.54 174.3 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.919 0.39 . . . . 0.0 110.829 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 23.2 m -145.56 134.86 22.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.858 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -106.67 -166.79 22.59 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.517 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -152.16 163.24 39.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.882 0.372 . . . . 0.0 110.849 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 2.6 p -173.93 134.13 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -166.54 113.1 0.53 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.495 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.8 t -158.84 142.71 15.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.369 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -70.05 119.66 8.98 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.459 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -90.9 165.85 13.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.37 151.49 8.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.5 mp -143.94 108.58 4.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -86.84 124.82 33.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.431 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -69.25 105.45 2.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 4.1 m -59.57 152.94 20.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -106.17 -40.03 2.02 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.513 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -62.88 97.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.901 0.381 . . . . 0.0 110.923 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -138.89 69.64 43.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.592 0.71 . . . . 0.0 110.923 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 156.81 62.37 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.636 2.224 . . . . 0.0 112.352 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -123.09 125.94 46.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -82.0 177.66 53.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.528 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -36.08 11.39 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.709 2.272 . . . . 0.0 112.322 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 30.4 t -85.16 112.29 20.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.3 m -158.3 132.34 7.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.849 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.464 -179.964 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 31.3 t -71.66 117.12 12.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.85 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.6 m -53.02 -53.84 44.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 167.87 -127.03 1.49 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.486 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 73.1 m -150.04 -178.98 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.373 . . . . 0.0 110.85 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.6 m -123.75 -68.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.897 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 90.53 66.99 1.19 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.9 t -156.39 166.74 32.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 111.156 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 106.61 86.67 1.9 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.484 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -61.19 -177.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.922 0.391 . . . . 0.0 110.904 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -55.79 144.55 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.85 104.76 16.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.96 126.41 29.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.954 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.43 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -63.42 104.95 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 86.8 p -96.66 126.27 41.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.836 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -79.64 -30.87 42.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.48 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 62.67 33.29 15.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.893 0.378 . . . . 0.0 110.868 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 43.7 mttm 57.42 71.88 1.02 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 0.0 110.878 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 178.32 4.73 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.645 2.23 . . . . 0.0 112.351 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 27.1 t -158.51 159.24 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -68.2 -72.31 0.83 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 162.36 42.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.664 2.243 . . . . 0.0 112.36 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 11.0 m -93.73 128.69 40.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.8 p -76.02 79.21 2.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.171 -0.794 . . . . 0.0 112.48 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 2.8 t -125.15 125.36 43.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.927 0.394 . . . . 0.0 110.864 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 13.9 m -80.32 174.72 11.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.845 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -154.36 38.39 0.67 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -99.06 128.35 45.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.4 p -161.51 -178.45 6.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 93.34 52.64 1.99 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.468 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.5 m -103.5 88.59 3.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -147.77 118.16 0.97 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.474 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -101.57 152.95 20.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.882 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -99.59 44.4 1.02 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.46 97.55 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -70.49 114.17 8.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.426 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -52.37 114.99 1.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.5 t -86.74 124.52 33.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.85 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.79 34.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.469 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -118.56 97.35 5.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.82 70.89 0.9 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.699 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 104.48 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.709 2.273 . . . . 0.0 112.354 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 5.2 t -107.54 145.3 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 171.6 -178.48 43.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.489 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 128.97 16.81 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.73 2.286 . . . . 0.0 112.369 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 63.1 m -74.5 -176.92 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.8 t -170.42 171.83 6.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.854 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 CA-C-O 119.077 -0.846 . . . . 0.0 112.484 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.491 -0.243 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.4 m 54.57 29.59 11.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.856 0.36 . . . . 0.0 110.888 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 71.5 m -79.15 -36.53 40.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.854 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -82.59 -174.54 50.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.525 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 50.3 m -107.3 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.793 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 31.3 p -133.97 -61.06 0.8 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.905 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.48 79.54 1.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.463 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.0 m -100.1 -37.2 9.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.859 0.361 . . . . 0.0 111.165 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -98.19 103.22 2.77 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -122.89 85.89 2.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.925 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 174.39 11.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 24.5 mt 51.85 46.76 26.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -58.44 120.59 9.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.944 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.432 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -93.52 104.14 16.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.7 m -71.66 179.72 2.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 163.07 -62.97 0.26 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.496 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -125.98 29.74 5.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.927 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -148.9 71.72 10.37 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.861 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 90.68 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 0.0 112.367 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 13.7 p -68.74 -177.65 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.1 -75.02 0.84 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.487 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 160.7 48.72 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.712 2.275 . . . . 0.0 112.302 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.7 t -145.04 150.57 37.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.853 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 93.7 p -120.52 35.88 4.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 119.163 -0.799 . . . . 0.0 112.46 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 59.4 p -171.92 177.72 3.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.896 0.379 . . . . 0.0 110.847 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 27.2 t -106.98 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.813 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 134.65 50.39 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.456 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 4.4 m -95.75 99.5 11.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.875 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.1 t -139.98 160.0 40.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.82 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 98.69 104.04 2.43 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 p -71.86 171.34 11.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.121 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -131.29 52.23 0.83 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.501 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -138.78 175.75 9.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.0 110.87 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 18.5 tttp -123.1 161.88 23.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 55.1 mt -136.41 107.08 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -64.27 122.72 17.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.427 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -67.87 116.71 8.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 43.8 m -138.08 170.77 15.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -98.76 -23.87 11.45 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.517 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -67.55 128.9 38.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -136.01 160.64 66.48 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 -17.14 37.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.626 2.217 . . . . 0.0 112.36 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -133.98 107.27 7.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.86 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.74 175.89 51.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.428 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -172.03 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.67 2.246 . . . . 0.0 112.359 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 35.4 m -135.96 86.85 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.6 t -94.96 137.85 33.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.873 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.107 -0.83 . . . . 0.0 112.506 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 6.4 t -149.54 112.18 4.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.888 0.375 . . . . 0.0 110.828 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 7.0 t -133.09 138.39 46.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -179.78 -123.91 0.86 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.471 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 9.1 p -130.92 144.93 51.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.835 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 44.4 m -140.03 179.58 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 66.07 83.99 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.7 m -93.63 119.44 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.837 0.351 . . . . 0.0 111.129 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -67.72 128.2 26.34 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.512 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -133.19 139.55 47.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.897 0.379 . . . . 0.0 110.898 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.21 135.9 38.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.2 mp -135.19 116.3 14.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.939 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.19 114.3 16.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.924 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.434 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -60.01 -69.88 0.19 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 26.5 p -56.47 156.27 6.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -75.54 126.81 8.74 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.459 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -128.45 29.23 5.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.907 0.384 . . . . 0.0 110.891 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -137.0 160.67 65.23 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.585 0.707 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -23.92 30.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 0.0 112.325 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 56.3 p -72.86 -35.71 67.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.12 174.78 38.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.52 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -24.14 29.62 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.666 2.244 . . . . 0.0 112.315 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 15.6 m -92.03 96.8 10.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.803 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 61.8 p -84.36 176.09 8.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.179 -0.79 . . . . 0.0 112.478 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 50.8 m -89.97 -45.92 8.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.82 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -101.15 157.83 16.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -104.0 -99.95 2.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.476 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 6.0 m -119.58 143.34 47.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.867 0.365 . . . . 0.0 110.843 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 60.6 p -172.43 121.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 143.84 79.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.467 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.6 t -164.05 126.94 2.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -173.09 38.17 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.49 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -95.81 138.05 34.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.973 0.416 . . . . 0.0 110.843 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -87.16 107.83 18.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 10.4 mt -77.92 100.97 6.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -65.21 119.58 11.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.423 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -62.91 -176.55 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.7 p 54.93 29.75 12.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.69 144.42 15.55 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.465 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -135.77 133.74 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 110.856 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -79.58 160.69 69.22 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 110.885 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 85.94 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 0.0 112.372 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 29.2 m -96.72 69.74 2.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.852 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 155.07 174.09 24.58 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 179.56 3.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.707 2.272 . . . . 0.0 112.319 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 2.2 t -56.51 138.94 50.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.9 m -89.15 141.74 28.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.472 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 t -89.01 151.08 22.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.846 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.7 m -109.28 -31.98 7.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.835 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 129.94 -92.02 0.31 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.3 p -146.36 177.2 9.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.935 0.398 . . . . 0.0 110.79 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 39.9 t -87.84 92.96 9.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.887 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 64.95 -102.69 0.67 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m 57.42 28.22 15.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.87 0.367 . . . . 0.0 111.178 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -108.9 179.83 21.27 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.507 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -136.4 171.2 14.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.895 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -120.65 138.42 53.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.4 mt -96.61 108.59 21.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -81.27 127.97 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.433 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -61.3 116.23 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 30.9 t -69.25 158.6 34.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -141.4 -68.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.48 116.02 10.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -70.26 160.68 80.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.587 0.708 . . . . 0.0 110.924 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 158.62 56.28 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.631 2.221 . . . . 0.0 112.345 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -100.79 93.9 5.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.68 -173.24 54.61 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.482 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -47.44 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.238 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 34.7 t -95.82 165.08 12.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.884 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 57.8 m -53.63 160.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.803 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 119.142 -0.81 . . . . 0.0 112.459 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.2 t -120.45 123.23 42.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.907 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.8 t -117.71 -61.44 1.69 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -75.73 102.25 1.5 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.519 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 42.8 t -63.68 159.96 17.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.839 0.352 . . . . 0.0 110.922 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 77.7 p -87.69 126.48 35.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.854 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -141.59 132.91 5.5 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 30.5 p -132.62 73.74 1.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.346 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -151.42 -149.28 5.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.498 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -134.45 117.02 15.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.928 0.394 . . . . 0.0 110.904 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -163.05 175.84 10.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 58.7 mt 58.45 51.79 7.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -60.99 119.63 8.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.429 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -71.86 122.07 20.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 11.2 t -90.76 63.98 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -109.15 -78.96 1.08 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -107.17 127.12 53.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.929 0.395 . . . . 0.0 110.871 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -137.89 160.65 63.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.564 0.697 . . . . 0.0 110.896 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 177.43 5.57 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 0.0 112.363 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 6.1 t -104.51 143.61 32.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.832 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -166.96 -74.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.504 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 101.13 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.668 2.245 . . . . 0.0 112.336 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 7.6 t -132.75 -177.13 4.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.8 t -56.43 125.92 24.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.499 -179.956 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 37.0 m -94.92 142.63 27.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.925 0.393 . . . . 0.0 110.863 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.4 m -158.89 163.01 36.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 177.77 138.02 2.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.518 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 14.8 m -163.07 145.21 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.94 0.4 . . . . 0.0 110.804 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.6 m -155.7 117.15 3.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 158.1 126.15 0.87 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.462 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 50.2 p -115.1 171.12 7.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.816 0.341 . . . . 0.0 111.121 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 85.41 142.12 6.03 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.511 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -115.6 26.39 10.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 110.891 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.12 141.32 28.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 36.3 mt -148.84 82.0 1.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -122.56 128.87 51.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.423 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.87 100.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 37.1 t -66.7 -64.13 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.19 177.74 20.4 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.427 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -109.67 155.73 21.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.878 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 55.4 mttt 57.04 70.39 1.4 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.551 0.691 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 156.17 64.07 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.736 2.29 . . . . 0.0 112.336 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 18.1 t -113.79 118.3 33.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.64 -170.49 26.9 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 109.92 2.42 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.71 2.273 . . . . 0.0 112.354 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.9 t -73.33 112.09 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.1 t -96.66 140.26 31.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.533 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 30.7 t -132.26 94.3 3.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.854 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.1 m -133.61 65.25 1.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.835 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.37 58.61 0.25 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.475 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.5 m -96.78 101.05 12.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 110.865 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.3 t -65.17 148.38 51.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.85 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 159.19 167.49 19.94 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.536 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 9.0 t -171.66 150.18 2.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -76.54 -57.26 3.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.48 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -102.36 122.75 44.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.906 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -99.58 164.37 12.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.863 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.16 99.79 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.915 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -76.12 118.8 19.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.942 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.428 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.428 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -58.73 101.3 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.8 t -143.4 140.89 30.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -102.97 -107.23 3.13 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -112.24 -45.94 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 0.0 110.848 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -140.54 160.68 58.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.584 0.707 . . . . 0.0 110.873 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -27.82 26.22 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.648 2.232 . . . . 0.0 112.375 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 3.4 m -97.46 160.9 14.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -86.58 176.12 47.8 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.515 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.78 163.52 37.98 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.673 2.249 . . . . 0.0 112.324 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 m -158.37 124.93 4.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.899 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.9 p -108.22 167.62 9.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.867 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 CA-C-O 119.106 -0.83 . . . . 0.0 112.473 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 4.9 t -82.47 107.82 15.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 0.0 110.884 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 14.0 p -133.9 -42.93 0.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.846 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -64.98 113.48 5.91 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.471 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 59.6 p -99.34 128.66 45.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -111.44 37.54 2.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -91.3 77.07 1.42 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.509 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 43.4 p -106.01 108.33 19.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.344 . . . . 0.0 111.141 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -73.82 -33.69 57.34 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.504 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.82 161.92 30.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -129.03 158.9 37.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -80.75 100.64 8.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -54.02 132.77 43.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.9 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.414 ' CB ' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.48 -177.72 6.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 3.8 t -98.95 172.33 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 129.94 71.83 0.12 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -106.84 85.23 2.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.893 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 37.7 tptt 52.4 71.88 1.34 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.555 0.693 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 159.95 51.55 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.655 2.236 . . . . 0.0 112.373 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.5 m -70.7 -30.55 67.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 141.2 174.17 14.06 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 110.44 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.631 2.221 . . . . 0.0 112.368 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 13.6 p -121.37 55.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.873 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.4 p -134.32 154.28 51.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.506 -179.977 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 m 62.32 33.93 16.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 0.0 110.855 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 79.2 p -120.99 119.22 31.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.38 96.03 0.13 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.7 t -57.78 114.81 2.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.833 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 40.4 t -95.16 53.64 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.883 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -109.13 22.79 24.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.507 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -108.77 99.64 8.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 111.102 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -134.66 46.34 1.05 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.455 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -91.9 174.48 7.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 110.892 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -140.06 150.67 44.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 5.5 mp -126.92 116.63 21.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -78.26 122.3 25.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.926 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ALA . . . . . 0.434 ' N ' ' CD ' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.88 118.88 12.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 34.2 t -116.68 -72.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -164.57 77.13 0.15 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.454 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -105.79 145.8 30.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 0.0 110.849 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -133.77 157.58 77.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.54 0.686 . . . . 0.0 110.861 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 79.75 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.665 2.243 . . . . 0.0 112.326 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 17.3 m -157.92 163.65 37.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.896 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 160.74 171.03 26.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.52 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 120.65 7.41 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.666 2.244 . . . . 0.0 112.378 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 12.7 p -101.04 89.94 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 58.4 m -91.09 164.29 13.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.838 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.505 179.948 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.2 m-85 . . . . . 0 N--CA 1.458 -0.049 0 CA-C-O 120.854 0.359 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.643 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.732 ' HA ' HD12 ' A' ' 477' ' ' LEU . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 474' ' ' HIS . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.686 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.5 m-85 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.86 0.362 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.686 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.571 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 474' ' ' HIS . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.444 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.6 m-85 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.878 0.371 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.552 ' H ' HD13 ' A' ' 471' ' ' LEU . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.444 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 472' ' ' LEU . 9.0 m-85 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.907 0.384 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.821 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.821 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 456' ' ' TYR . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.545 HD11 ' CZ ' ' A' ' 456' ' ' TYR . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.705 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.3 m-85 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.88 0.372 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.854 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.854 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.705 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.415 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 474' ' ' HIS . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.633 ' CE1' HD21 ' A' ' 472' ' ' LEU . 26.0 m-85 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.419 HD23 ' CB ' ' A' ' 456' ' ' TYR . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.633 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.719 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.1 m-85 . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.824 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.824 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.751 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.4 m-85 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.888 0.375 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.852 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.751 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.726 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.2 m-85 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.917 0.389 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' ASN . . . . . 0.566 ' HA ' HD21 ' A' ' 471' ' ' LEU . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.497 ' H ' HD13 ' A' ' 471' ' ' LEU . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 457' ' ' ASN . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.622 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 474' ' ' HIS . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.707 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.7 m-85 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.893 0.378 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.707 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.671 ' CE1' HD11 ' A' ' 472' ' ' LEU . 30.9 m-85 . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.421 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.671 HD11 ' CE1' ' A' ' 456' ' ' TYR . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.703 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.7 m-85 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.432 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.432 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.703 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.9 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.892 0.377 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 24.8 m-20 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.502 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.687 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 474' ' ' HIS . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.617 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.3 m-85 . . . . . 0 N--CA 1.458 -0.047 0 CA-C-O 120.886 0.375 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 457' ' ' ASN . . . . . 0.444 ' HA ' HD21 ' A' ' 471' ' ' LEU . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.444 HD21 ' HA ' ' A' ' 457' ' ' ASN . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.617 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.624 ' CE1' HD21 ' A' ' 472' ' ' LEU . 13.6 m-85 . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.846 0.355 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.808 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.808 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.624 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.646 ' CE1' HD11 ' A' ' 472' ' ' LEU . 28.7 m-85 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.417 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.841 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.417 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.646 HD11 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.519 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.6 m-85 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.9 0.381 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 457' ' ' ASN . . . . . 0.481 ' HA ' HD21 ' A' ' 471' ' ' LEU . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.593 ' H ' HD13 ' A' ' 471' ' ' LEU . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.593 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.775 ' HA ' HD12 ' A' ' 477' ' ' LEU . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 474' ' ' HIS . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.653 ' CE1' HD21 ' A' ' 472' ' ' LEU . 20.6 m-85 . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.891 0.377 . . . . 0.0 110.942 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.816 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.816 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.653 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 474' ' ' HIS . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.727 ' CE1' HD21 ' A' ' 472' ' ' LEU . 15.3 m-85 . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.882 0.373 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.537 ' H ' HD13 ' A' ' 471' ' ' LEU . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.537 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.727 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 456' ' ' TYR . . . . . 0.401 ' CB ' HD23 ' A' ' 471' ' ' LEU . 14.6 m-85 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 465' ' ' PHE . . . . . 0.459 ' H ' HD13 ' A' ' 471' ' ' LEU . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ALA . . . . . 0.813 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.813 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.459 HD13 ' H ' ' A' ' 465' ' ' PHE . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.432 -0.267 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.7 m -109.73 53.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.891 0.377 . . . . 0.0 110.873 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 28.4 p -77.78 122.88 26.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -177.08 98.1 0.12 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 47.6 t -101.89 114.29 28.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 110.868 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 10.3 m -83.61 109.9 17.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.824 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 150.34 -163.7 29.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.488 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.1 t -118.59 -31.55 4.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 0.0 111.146 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -106.02 101.11 1.76 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.485 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -81.48 79.05 8.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.895 0.379 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.52 141.32 39.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.901 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.07 110.99 17.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.956 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.2 m-85 -67.3 124.49 23.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.643 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.732 ' HA ' HD12 ' A' ' 477' ' ' LEU . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 474' ' ' HIS . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -76.19 75.42 3.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -106.41 74.61 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 61.07 -132.9 49.05 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.526 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -140.12 140.33 36.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.874 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.36 73.31 0.74 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.632 0.73 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 86.67 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 2.264 . . . . 0.0 112.331 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -89.07 95.18 10.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.822 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -58.75 -179.16 1.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.517 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -31.89 19.42 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.718 2.279 . . . . 0.0 112.305 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 t 53.11 51.9 14.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.86 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.4 m -82.12 170.02 15.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.157 -0.802 . . . . 0.0 112.448 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.9 m -67.32 135.11 52.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.862 0.363 . . . . 0.0 110.872 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 26.0 t -139.3 157.02 46.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.848 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -92.23 -152.74 29.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -143.68 167.16 22.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.884 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.1 m -100.39 112.2 24.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.86 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 162.3 -79.91 0.14 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 62.5 p -54.03 150.85 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 0.0 111.141 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 109.72 -37.31 3.84 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.445 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.8 153.72 45.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.88 0.372 . . . . 0.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -170.45 129.6 0.86 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.0 mt -137.78 113.73 9.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.686 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.5 m-85 -65.46 121.9 15.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.686 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.571 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 474' ' ' HIS . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -67.28 123.93 21.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.2 m 52.41 33.89 13.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.833 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -59.17 -28.87 64.73 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.482 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -113.79 129.17 56.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.894 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 57.43 69.1 1.72 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.589 0.709 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -36.93 9.94 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 73.3 m -90.23 -63.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.865 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 166.08 -173.04 41.6 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.505 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 82.05 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.678 2.252 . . . . 0.0 112.369 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 3.1 t -112.89 132.35 55.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.0 t -92.63 137.28 32.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.888 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-O 119.177 -0.79 . . . . 0.0 112.445 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 14.7 t -70.55 113.3 7.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.851 0.357 . . . . 0.0 110.84 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 59.5 p -92.16 153.29 19.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -88.8 175.72 43.79 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.1 m -111.94 -175.64 2.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.831 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.5 m -95.96 127.19 41.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -142.94 34.09 1.8 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.454 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.1 m -116.28 77.46 1.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 0.0 111.128 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 98.86 141.39 12.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -102.42 56.65 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.402 . . . . 0.0 110.913 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -117.86 103.53 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 95.5 mt -145.09 107.17 4.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.444 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.6 m-85 -117.6 119.4 34.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.552 ' H ' HD13 ' A' ' 471' ' ' LEU . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.444 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -68.59 -178.13 1.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 39.8 t -81.69 -66.05 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 70.69 126.11 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.485 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -102.37 -40.07 6.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -118.76 71.31 10.21 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.555 0.693 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -21.22 33.9 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.681 2.254 . . . . 0.0 112.385 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.68 50.59 10.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -100.88 166.6 19.28 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 158.98 55.15 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.676 2.251 . . . . 0.0 112.353 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 19.1 m -99.42 -42.76 6.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.9 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.0 t -90.66 106.04 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.378 0 CA-C-O 119.152 -0.805 . . . . 0.0 112.514 -179.985 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 88.6 p -125.55 119.57 28.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.83 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.0 t -79.27 97.94 6.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 133.77 98.76 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 10.4 p -117.0 -64.37 1.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.6 t -158.71 113.2 2.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.885 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.35 118.28 4.86 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 70.9 p -122.68 30.04 6.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.817 0.341 . . . . 0.0 111.152 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -71.5 -100.24 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.518 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -66.55 164.27 16.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.0 110.867 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.84 145.77 43.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.7 mp -108.48 97.87 7.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 472' ' ' LEU . 9.0 m-85 -71.09 132.59 45.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.821 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.821 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 456' ' ' TYR . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.545 HD11 ' CZ ' ' A' ' 456' ' ' TYR . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -58.18 104.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 72.2 m -95.99 173.26 7.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.897 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -100.11 78.99 0.46 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.03 93.96 3.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.922 0.391 . . . . 0.0 110.912 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -132.4 72.11 78.58 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.594 0.711 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 -25.96 28.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.6 m -65.33 163.54 15.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.2 -175.0 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.494 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -17.17 37.73 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.694 2.262 . . . . 0.0 112.363 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 60.0 p -70.01 -48.76 56.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 26.6 m -108.68 124.97 51.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.868 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.506 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 40.0 p -164.92 122.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.86 0.362 . . . . 0.0 110.845 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.5 p -169.34 179.73 3.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.864 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 79.6 72.7 1.18 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.464 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 20.2 m -95.55 80.98 3.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.861 0.362 . . . . 0.0 110.86 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 23.0 t -56.11 168.23 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.823 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 136.76 159.1 8.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.529 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 34.6 p -127.13 109.95 12.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.802 0.334 . . . . 0.0 111.185 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -110.07 -39.0 1.6 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.505 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -103.31 147.37 27.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.931 0.396 . . . . 0.0 110.878 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -135.82 141.95 44.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.9 mp -127.2 122.74 34.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.705 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.3 m-85 -67.55 118.21 10.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.854 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.854 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.705 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.415 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 474' ' ' HIS . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 -53.44 108.3 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.3 m -71.15 96.97 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -160.13 138.67 5.68 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.88 44.56 2.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.902 0.382 . . . . 0.0 110.893 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? 56.66 68.9 1.94 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -22.24 32.24 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.676 2.25 . . . . 0.0 112.327 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.2 m -91.1 131.38 36.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 77.2 168.31 29.69 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -171.43 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.705 2.27 . . . . 0.0 112.357 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 4.6 m -133.74 120.67 20.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.833 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.8 p -111.36 55.83 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 20.1 m -133.6 -68.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.894 0.378 . . . . 0.0 110.875 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 3.2 p -98.91 -54.93 2.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -159.35 105.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.476 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 3.6 m -76.18 176.15 8.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.862 0.363 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 57.0 m -77.2 107.7 9.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -98.47 -172.16 32.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.486 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.9 m -79.86 137.43 36.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -89.23 142.87 17.05 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.497 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -118.2 163.7 16.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.906 0.384 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -79.38 142.17 36.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.1 mp -111.94 93.26 4.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.957 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.633 ' CE1' HD21 ' A' ' 472' ' ' LEU . 26.0 m-85 -73.28 125.72 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.419 HD23 ' CB ' ' A' ' 456' ' ' TYR . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.633 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -53.03 125.31 16.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 75.4 m -158.28 173.63 16.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.8 84.48 0.12 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.478 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -72.54 -40.23 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.942 0.401 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? 52.73 71.39 1.46 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.693 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -19.3 36.14 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.675 2.25 . . . . 0.0 112.354 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 50.7 m -97.38 51.52 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.814 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 58.34 177.87 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.48 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 179.52 3.66 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.642 2.228 . . . . 0.0 112.331 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 20.0 t -89.09 94.55 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 11.8 p -62.9 138.36 58.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 CA-C-O 119.143 -0.81 . . . . 0.0 112.496 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.9 m -110.13 104.39 13.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.375 . . . . 0.0 110.863 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.8 p -123.31 162.36 22.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.856 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -163.75 114.4 0.6 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.49 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 57.8 m -93.83 56.17 2.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.906 0.384 . . . . 0.0 110.856 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 p -79.36 173.23 12.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.834 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 92.43 71.28 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.493 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.7 t -158.36 161.36 37.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.139 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 143.22 103.15 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.448 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -139.06 177.54 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.938 0.399 . . . . 0.0 110.847 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -152.36 138.56 18.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 62.2 mt -152.75 116.8 4.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.719 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.1 m-85 -61.36 118.26 6.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.96 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.824 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.824 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 -66.04 -178.55 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.8 t -113.07 159.27 19.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.795 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.78 -65.42 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -78.85 149.59 32.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -114.85 71.9 2.69 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.547 0.689 . . . . 0.0 110.869 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -175.08 1.04 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 0.0 112.317 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 79.5 p -121.55 -34.49 3.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 105.66 169.47 23.56 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 106.4 1.66 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.681 2.254 . . . . 0.0 112.313 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 85.2 p -133.95 144.32 48.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.6 t -102.45 89.57 3.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 CA-C-O 119.141 -0.811 . . . . 0.0 112.433 -179.941 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.6 m -132.54 174.3 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.919 0.39 . . . . 0.0 110.829 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 23.2 m -145.56 134.86 22.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.858 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -106.67 -166.79 22.59 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.517 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -152.16 163.24 39.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.882 0.372 . . . . 0.0 110.849 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 2.6 p -173.93 134.13 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -166.54 113.1 0.53 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.495 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.8 t -158.84 142.71 15.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.369 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -70.05 119.66 8.98 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.459 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -90.9 165.85 13.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.37 151.49 8.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.5 mp -143.94 108.58 4.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.751 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.4 m-85 -86.84 124.82 33.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.852 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.751 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -69.25 105.45 2.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 4.1 m -59.57 152.94 20.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -106.17 -40.03 2.02 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.513 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -62.88 97.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.901 0.381 . . . . 0.0 110.923 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -138.89 69.64 43.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.592 0.71 . . . . 0.0 110.923 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 156.81 62.37 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.636 2.224 . . . . 0.0 112.352 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -123.09 125.94 46.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -82.0 177.66 53.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.528 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -36.08 11.39 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.709 2.272 . . . . 0.0 112.322 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 30.4 t -85.16 112.29 20.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.3 m -158.3 132.34 7.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.849 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.464 -179.964 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 31.3 t -71.66 117.12 12.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.85 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.6 m -53.02 -53.84 44.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 167.87 -127.03 1.49 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.486 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 73.1 m -150.04 -178.98 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.373 . . . . 0.0 110.85 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.6 m -123.75 -68.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.897 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 90.53 66.99 1.19 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.9 t -156.39 166.74 32.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 111.156 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 106.61 86.67 1.9 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.484 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -61.19 -177.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.922 0.391 . . . . 0.0 110.904 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -55.79 144.55 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.85 104.76 16.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.726 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.2 m-85 -67.96 126.41 29.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.954 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' ASN . . . . . 0.566 ' HA ' HD21 ' A' ' 471' ' ' LEU . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.497 ' H ' HD13 ' A' ' 471' ' ' LEU . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 457' ' ' ASN . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.622 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 474' ' ' HIS . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -63.42 104.95 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 86.8 p -96.66 126.27 41.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.836 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -79.64 -30.87 42.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.48 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 62.67 33.29 15.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.893 0.378 . . . . 0.0 110.868 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 43.7 mttm 57.42 71.88 1.02 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 0.0 110.878 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 178.32 4.73 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.645 2.23 . . . . 0.0 112.351 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 27.1 t -158.51 159.24 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -68.2 -72.31 0.83 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 162.36 42.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.664 2.243 . . . . 0.0 112.36 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 11.0 m -93.73 128.69 40.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.8 p -76.02 79.21 2.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.171 -0.794 . . . . 0.0 112.48 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 2.8 t -125.15 125.36 43.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.927 0.394 . . . . 0.0 110.864 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 13.9 m -80.32 174.72 11.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.845 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -154.36 38.39 0.67 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -99.06 128.35 45.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.4 p -161.51 -178.45 6.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 93.34 52.64 1.99 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.468 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.5 m -103.5 88.59 3.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -147.77 118.16 0.97 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.474 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -101.57 152.95 20.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.882 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -99.59 44.4 1.02 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.46 97.55 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.707 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.7 m-85 -70.49 114.17 8.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.707 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -52.37 114.99 1.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.5 t -86.74 124.52 33.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.85 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.79 34.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.469 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -118.56 97.35 5.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.82 70.89 0.9 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.699 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 104.48 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.709 2.273 . . . . 0.0 112.354 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 5.2 t -107.54 145.3 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 171.6 -178.48 43.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.489 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 128.97 16.81 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.73 2.286 . . . . 0.0 112.369 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 63.1 m -74.5 -176.92 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.8 t -170.42 171.83 6.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.854 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 CA-C-O 119.077 -0.846 . . . . 0.0 112.484 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.491 -0.243 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.4 m 54.57 29.59 11.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.856 0.36 . . . . 0.0 110.888 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 71.5 m -79.15 -36.53 40.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.854 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -82.59 -174.54 50.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.525 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 50.3 m -107.3 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.793 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 31.3 p -133.97 -61.06 0.8 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.905 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.48 79.54 1.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.463 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.0 m -100.1 -37.2 9.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.859 0.361 . . . . 0.0 111.165 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -98.19 103.22 2.77 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -122.89 85.89 2.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.925 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 174.39 11.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 24.5 mt 51.85 46.76 26.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.671 ' CE1' HD11 ' A' ' 472' ' ' LEU . 30.9 m-85 -58.44 120.59 9.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.421 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.671 HD11 ' CE1' ' A' ' 456' ' ' TYR . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -93.52 104.14 16.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.7 m -71.66 179.72 2.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 163.07 -62.97 0.26 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.496 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -125.98 29.74 5.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.927 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -148.9 71.72 10.37 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.861 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 90.68 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 0.0 112.367 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 13.7 p -68.74 -177.65 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.1 -75.02 0.84 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.487 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 160.7 48.72 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.712 2.275 . . . . 0.0 112.302 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.7 t -145.04 150.57 37.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.853 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 93.7 p -120.52 35.88 4.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 119.163 -0.799 . . . . 0.0 112.46 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 59.4 p -171.92 177.72 3.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.896 0.379 . . . . 0.0 110.847 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 27.2 t -106.98 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.813 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 134.65 50.39 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.456 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 4.4 m -95.75 99.5 11.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.875 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.1 t -139.98 160.0 40.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.82 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 98.69 104.04 2.43 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 p -71.86 171.34 11.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.121 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -131.29 52.23 0.83 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.501 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -138.78 175.75 9.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.0 110.87 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 18.5 tttp -123.1 161.88 23.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 55.1 mt -136.41 107.08 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.703 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.7 m-85 -64.27 122.72 17.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.432 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.432 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.703 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -67.87 116.71 8.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 43.8 m -138.08 170.77 15.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -98.76 -23.87 11.45 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.517 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -67.55 128.9 38.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -136.01 160.64 66.48 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 -17.14 37.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.626 2.217 . . . . 0.0 112.36 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -133.98 107.27 7.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.86 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.74 175.89 51.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.428 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -172.03 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.67 2.246 . . . . 0.0 112.359 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 35.4 m -135.96 86.85 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.6 t -94.96 137.85 33.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.873 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.107 -0.83 . . . . 0.0 112.506 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 6.4 t -149.54 112.18 4.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.888 0.375 . . . . 0.0 110.828 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 7.0 t -133.09 138.39 46.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -179.78 -123.91 0.86 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.471 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 9.1 p -130.92 144.93 51.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.835 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 44.4 m -140.03 179.58 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 66.07 83.99 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.7 m -93.63 119.44 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.837 0.351 . . . . 0.0 111.129 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -67.72 128.2 26.34 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.512 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -133.19 139.55 47.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.897 0.379 . . . . 0.0 110.898 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' LYS . . . . . 0.429 ' C ' HD12 ' A' ' 455' ' ' LEU . 0.1 OUTLIER -97.21 135.9 38.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.429 HD12 ' C ' ' A' ' 454' ' ' LYS . 6.2 mp -135.19 116.3 14.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.939 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.9 m-85 -78.19 114.3 16.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.924 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 24.8 m-20 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.502 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.687 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 474' ' ' HIS . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -60.01 -69.88 0.19 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 26.5 p -56.47 156.27 6.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -75.54 126.81 8.74 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.459 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -128.45 29.23 5.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.907 0.384 . . . . 0.0 110.891 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -137.0 160.67 65.23 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.585 0.707 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -23.92 30.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 0.0 112.325 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 56.3 p -72.86 -35.71 67.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.12 174.78 38.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.52 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -24.14 29.62 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.666 2.244 . . . . 0.0 112.315 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 15.6 m -92.03 96.8 10.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.803 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 61.8 p -84.36 176.09 8.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.179 -0.79 . . . . 0.0 112.478 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 50.8 m -89.97 -45.92 8.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.82 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -101.15 157.83 16.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -104.0 -99.95 2.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.476 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 6.0 m -119.58 143.34 47.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.867 0.365 . . . . 0.0 110.843 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 60.6 p -172.43 121.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 143.84 79.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.467 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.6 t -164.05 126.94 2.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -173.09 38.17 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.49 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -95.81 138.05 34.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.973 0.416 . . . . 0.0 110.843 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -87.16 107.83 18.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 10.4 mt -77.92 100.97 6.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.617 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.3 m-85 -65.21 119.58 11.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' ASN . . . . . 0.444 ' HA ' HD21 ' A' ' 471' ' ' LEU . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.444 HD21 ' HA ' ' A' ' 457' ' ' ASN . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.617 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -62.91 -176.55 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.7 p 54.93 29.75 12.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.69 144.42 15.55 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.465 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -135.77 133.74 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 110.856 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -79.58 160.69 69.22 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 110.885 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 85.94 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 0.0 112.372 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 29.2 m -96.72 69.74 2.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.852 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 155.07 174.09 24.58 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 179.56 3.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.707 2.272 . . . . 0.0 112.319 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 2.2 t -56.51 138.94 50.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.9 m -89.15 141.74 28.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.472 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 t -89.01 151.08 22.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.846 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.7 m -109.28 -31.98 7.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.835 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 129.94 -92.02 0.31 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.3 p -146.36 177.2 9.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.935 0.398 . . . . 0.0 110.79 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 39.9 t -87.84 92.96 9.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.887 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 64.95 -102.69 0.67 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m 57.42 28.22 15.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.87 0.367 . . . . 0.0 111.178 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -108.9 179.83 21.27 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.507 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -136.4 171.2 14.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.895 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -120.65 138.42 53.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.4 mt -96.61 108.59 21.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.624 ' CE1' HD21 ' A' ' 472' ' ' LEU . 13.6 m-85 -81.27 127.97 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.808 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.808 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.624 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -61.3 116.23 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 30.9 t -69.25 158.6 34.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -141.4 -68.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.48 116.02 10.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -70.26 160.68 80.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.587 0.708 . . . . 0.0 110.924 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 158.62 56.28 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.631 2.221 . . . . 0.0 112.345 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -100.79 93.9 5.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.68 -173.24 54.61 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.482 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -47.44 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.238 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 34.7 t -95.82 165.08 12.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.884 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 57.8 m -53.63 160.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.803 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 119.142 -0.81 . . . . 0.0 112.459 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.2 t -120.45 123.23 42.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.907 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.8 t -117.71 -61.44 1.69 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -75.73 102.25 1.5 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.519 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 42.8 t -63.68 159.96 17.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.839 0.352 . . . . 0.0 110.922 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 77.7 p -87.69 126.48 35.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.854 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -141.59 132.91 5.5 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 30.5 p -132.62 73.74 1.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.346 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -151.42 -149.28 5.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.498 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -134.45 117.02 15.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.928 0.394 . . . . 0.0 110.904 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -163.05 175.84 10.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 58.7 mt 58.45 51.79 7.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.646 ' CE1' HD11 ' A' ' 472' ' ' LEU . 28.7 m-85 -60.99 119.63 8.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.926 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.417 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.841 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.417 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.646 HD11 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -71.86 122.07 20.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 11.2 t -90.76 63.98 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -109.15 -78.96 1.08 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -107.17 127.12 53.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.929 0.395 . . . . 0.0 110.871 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -137.89 160.65 63.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.564 0.697 . . . . 0.0 110.896 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 177.43 5.57 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 0.0 112.363 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 6.1 t -104.51 143.61 32.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.832 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -166.96 -74.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.504 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 101.13 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.668 2.245 . . . . 0.0 112.336 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 7.6 t -132.75 -177.13 4.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.8 t -56.43 125.92 24.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.499 -179.956 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 37.0 m -94.92 142.63 27.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.925 0.393 . . . . 0.0 110.863 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.4 m -158.89 163.01 36.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 177.77 138.02 2.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.518 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 14.8 m -163.07 145.21 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.94 0.4 . . . . 0.0 110.804 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.6 m -155.7 117.15 3.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 158.1 126.15 0.87 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.462 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 50.2 p -115.1 171.12 7.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.816 0.341 . . . . 0.0 111.121 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 85.41 142.12 6.03 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.511 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -115.6 26.39 10.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 110.891 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' LYS . . . . . 0.452 ' O ' HD23 ' A' ' 455' ' ' LEU . 0.0 OUTLIER -95.12 141.32 28.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 454' ' ' LYS . 36.3 mt -148.84 82.0 1.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.519 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.6 m-85 -122.56 128.87 51.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' ASN . . . . . 0.481 ' HA ' HD21 ' A' ' 471' ' ' LEU . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.593 ' H ' HD13 ' A' ' 471' ' ' LEU . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.593 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.775 ' HA ' HD12 ' A' ' 477' ' ' LEU . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 474' ' ' HIS . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.87 100.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 37.1 t -66.7 -64.13 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.19 177.74 20.4 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.427 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -109.67 155.73 21.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.878 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 55.4 mttt 57.04 70.39 1.4 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.551 0.691 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 156.17 64.07 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.736 2.29 . . . . 0.0 112.336 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 18.1 t -113.79 118.3 33.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.64 -170.49 26.9 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 109.92 2.42 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.71 2.273 . . . . 0.0 112.354 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.9 t -73.33 112.09 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.1 t -96.66 140.26 31.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.533 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 30.7 t -132.26 94.3 3.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.854 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.1 m -133.61 65.25 1.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.835 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.37 58.61 0.25 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.475 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.5 m -96.78 101.05 12.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 110.865 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.3 t -65.17 148.38 51.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.85 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 159.19 167.49 19.94 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.536 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 9.0 t -171.66 150.18 2.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -76.54 -57.26 3.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.48 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -102.36 122.75 44.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.906 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -99.58 164.37 12.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.863 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 455' ' ' LEU . 4.3 mm? -74.16 99.79 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.915 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.653 ' CE1' HD21 ' A' ' 472' ' ' LEU . 20.6 m-85 -76.12 118.8 19.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.942 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.816 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.816 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.653 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 474' ' ' HIS . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -58.73 101.3 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.8 t -143.4 140.89 30.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -102.97 -107.23 3.13 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -112.24 -45.94 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 0.0 110.848 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -140.54 160.68 58.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.584 0.707 . . . . 0.0 110.873 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -27.82 26.22 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.648 2.232 . . . . 0.0 112.375 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 3.4 m -97.46 160.9 14.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -86.58 176.12 47.8 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.515 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.78 163.52 37.98 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.673 2.249 . . . . 0.0 112.324 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 m -158.37 124.93 4.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.899 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.9 p -108.22 167.62 9.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.867 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 CA-C-O 119.106 -0.83 . . . . 0.0 112.473 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 4.9 t -82.47 107.82 15.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 0.0 110.884 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 14.0 p -133.9 -42.93 0.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.846 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -64.98 113.48 5.91 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.471 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 59.6 p -99.34 128.66 45.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -111.44 37.54 2.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -91.3 77.07 1.42 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.509 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 43.4 p -106.01 108.33 19.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.344 . . . . 0.0 111.141 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -73.82 -33.69 57.34 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.504 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.82 161.92 30.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -129.03 158.9 37.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 455' ' ' LEU . 4.3 mm? -80.75 100.64 8.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.727 ' CE1' HD21 ' A' ' 472' ' ' LEU . 15.3 m-85 -54.02 132.77 43.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.9 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.537 ' H ' HD13 ' A' ' 471' ' ' LEU . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.537 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.727 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.48 -177.72 6.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 3.8 t -98.95 172.33 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 129.94 71.83 0.12 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -106.84 85.23 2.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.893 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 37.7 tptt 52.4 71.88 1.34 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.555 0.693 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 159.95 51.55 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.655 2.236 . . . . 0.0 112.373 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.5 m -70.7 -30.55 67.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 141.2 174.17 14.06 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 110.44 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.631 2.221 . . . . 0.0 112.368 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 13.6 p -121.37 55.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.873 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.4 p -134.32 154.28 51.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.506 -179.977 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 m 62.32 33.93 16.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 0.0 110.855 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 79.2 p -120.99 119.22 31.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.38 96.03 0.13 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.7 t -57.78 114.81 2.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.833 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 40.4 t -95.16 53.64 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.883 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -109.13 22.79 24.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.507 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -108.77 99.64 8.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 111.102 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -134.66 46.34 1.05 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.455 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -91.9 174.48 7.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 110.892 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -140.06 150.67 44.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 5.5 mp -126.92 116.63 21.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' TYR . . . . . 0.401 ' CB ' HD23 ' A' ' 471' ' ' LEU . 14.6 m-85 -78.26 122.3 25.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.926 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' PHE . . . . . 0.459 ' H ' HD13 ' A' ' 471' ' ' LEU . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ALA . . . . . 0.813 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.813 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.459 HD13 ' H ' ' A' ' 465' ' ' PHE . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.88 118.88 12.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 34.2 t -116.68 -72.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -164.57 77.13 0.15 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.454 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -105.79 145.8 30.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 0.0 110.849 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -133.77 157.58 77.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.54 0.686 . . . . 0.0 110.861 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 79.75 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.665 2.243 . . . . 0.0 112.326 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 17.3 m -157.92 163.65 37.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.896 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 160.74 171.03 26.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.52 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 120.65 7.41 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.666 2.244 . . . . 0.0 112.378 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 12.7 p -101.04 89.94 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 58.4 m -91.09 164.29 13.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.838 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.505 179.948 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.2 m-85 . . . . . 0 N--CA 1.458 -0.049 0 CA-C-O 120.854 0.359 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.643 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.732 ' HA ' HD12 ' A' ' 477' ' ' LEU . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 474' ' ' HIS . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.686 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.5 m-85 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.86 0.362 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.686 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.571 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 474' ' ' HIS . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.444 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.6 m-85 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.878 0.371 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.552 ' H ' HD13 ' A' ' 471' ' ' LEU . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.444 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 472' ' ' LEU . 9.0 m-85 . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.907 0.384 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.821 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.821 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 456' ' ' TYR . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.545 HD11 ' CZ ' ' A' ' 456' ' ' TYR . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.705 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.3 m-85 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.88 0.372 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.854 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.854 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.705 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.415 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 474' ' ' HIS . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.633 ' CE1' HD21 ' A' ' 472' ' ' LEU . 26.0 m-85 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.419 HD23 ' CB ' ' A' ' 456' ' ' TYR . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.633 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.719 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.1 m-85 . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.824 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.824 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.751 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.4 m-85 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.888 0.375 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.852 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.751 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.726 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.2 m-85 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.917 0.389 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . 0.566 ' HA ' HD21 ' A' ' 471' ' ' LEU . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.497 ' H ' HD13 ' A' ' 471' ' ' LEU . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 457' ' ' ASN . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.622 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 474' ' ' HIS . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.707 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.7 m-85 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.893 0.378 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.707 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.671 ' CE1' HD11 ' A' ' 472' ' ' LEU . 30.9 m-85 . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.421 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.671 HD11 ' CE1' ' A' ' 456' ' ' TYR . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.703 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.7 m-85 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.432 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.432 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.703 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.9 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.892 0.377 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.502 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.687 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 474' ' ' HIS . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.617 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.3 m-85 . . . . . 0 N--CA 1.458 -0.047 0 CA-C-O 120.886 0.375 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . 0.444 ' HA ' HD21 ' A' ' 471' ' ' LEU . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.444 HD21 ' HA ' ' A' ' 457' ' ' ASN . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.617 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.624 ' CE1' HD21 ' A' ' 472' ' ' LEU . 13.6 m-85 . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.846 0.355 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.808 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.808 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.624 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.646 ' CE1' HD11 ' A' ' 472' ' ' LEU . 28.7 m-85 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.858 0.361 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.417 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.841 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.417 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.646 HD11 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.519 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.6 m-85 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.9 0.381 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . 0.481 ' HA ' HD21 ' A' ' 471' ' ' LEU . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.593 ' H ' HD13 ' A' ' 471' ' ' LEU . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.593 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.775 ' HA ' HD12 ' A' ' 477' ' ' LEU . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 474' ' ' HIS . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.653 ' CE1' HD21 ' A' ' 472' ' ' LEU . 20.6 m-85 . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.891 0.377 . . . . 0.0 110.942 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.816 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.816 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.653 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 474' ' ' HIS . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.727 ' CE1' HD21 ' A' ' 472' ' ' LEU . 15.3 m-85 . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.882 0.373 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.537 ' H ' HD13 ' A' ' 471' ' ' LEU . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.537 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.727 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' TYR . . . . . 0.401 ' CB ' HD23 ' A' ' 471' ' ' LEU . 14.6 m-85 . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . 0.459 ' H ' HD13 ' A' ' 471' ' ' LEU . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ALA . . . . . 0.813 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.813 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.459 HD13 ' H ' ' A' ' 465' ' ' PHE . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.432 -0.267 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.7 m -109.73 53.25 0.7 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.891 0.377 . . . . 0.0 110.873 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 28.4 p -77.78 122.88 26.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -177.08 98.1 0.12 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.483 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 47.6 t -101.89 114.29 28.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 110.868 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 10.3 m -83.61 109.9 17.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.824 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 150.34 -163.7 29.59 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.488 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.1 t -118.59 -31.55 4.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.35 . . . . 0.0 111.146 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -106.02 101.11 1.76 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.485 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -81.48 79.05 8.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.895 0.379 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.52 141.32 39.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.901 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.07 110.99 17.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.956 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.2 m-85 -67.3 124.49 23.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.937 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -171.23 125.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 14.0 t -75.06 125.86 29.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.895 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -101.19 -26.74 13.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -53.64 -67.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 26.0 p -91.19 -26.63 18.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 69.27 1.39 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -143.33 134.49 25.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.787 0.327 . . . . 0.0 110.901 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 63.2 p -106.06 101.6 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.851 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -69.44 164.85 22.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.89 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.0 m -85.47 -33.07 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 23.0 mmt85 -98.86 123.84 43.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.828 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.44 -55.01 50.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.559 0.695 . . . . 0.0 111.06 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.828 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.7 Cg_exo -47.99 -46.21 22.69 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.722 2.281 . . . . 0.0 112.328 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 7.7 m -70.04 -35.3 74.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.2 tp -63.52 -48.27 78.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.643 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.1 mt -55.58 -39.77 71.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttp -74.64 -32.5 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.919 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.732 ' HA ' HD12 ' A' ' 477' ' ' LEU . 72.8 t60 -63.34 -36.2 82.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -64.23 -29.37 70.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -80.33 -26.71 38.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.732 HD12 ' HA ' ' A' ' 474' ' ' HIS . 24.5 mt -62.11 -27.28 68.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -76.19 75.42 3.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -106.41 74.61 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 61.07 -132.9 49.05 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.526 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -140.12 140.33 36.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.874 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.36 73.31 0.74 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.632 0.73 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 86.67 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 2.264 . . . . 0.0 112.331 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -89.07 95.18 10.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.822 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -58.75 -179.16 1.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.517 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -31.89 19.42 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.718 2.279 . . . . 0.0 112.305 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 t 53.11 51.9 14.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.86 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.4 m -82.12 170.02 15.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.157 -0.802 . . . . 0.0 112.448 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 38.9 m -67.32 135.11 52.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.862 0.363 . . . . 0.0 110.872 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 26.0 t -139.3 157.02 46.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.848 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -92.23 -152.74 29.14 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -143.68 167.16 22.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.884 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.1 m -100.39 112.2 24.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.86 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 162.3 -79.91 0.14 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.501 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 62.5 p -54.03 150.85 7.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 0.0 111.141 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 109.72 -37.31 3.84 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.445 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.8 153.72 45.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.88 0.372 . . . . 0.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -170.45 129.6 0.86 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.0 mt -137.78 113.73 9.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.914 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.686 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.5 m-85 -65.46 121.9 15.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -172.46 119.34 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.6 t -72.43 134.67 45.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.909 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -109.27 -27.28 9.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.01 -52.5 60.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.856 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 31.7 p -105.33 -26.19 12.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.94 60.32 2.45 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -135.51 123.28 22.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 61.4 p -95.65 94.25 7.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.823 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -59.74 155.94 14.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.887 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.4 m -72.23 -49.77 32.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -84.2 137.06 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -70.01 -55.03 8.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.606 0.717 . . . . 0.0 111.098 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.0 -39.86 33.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.629 2.219 . . . . 0.0 112.344 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 90.6 m -72.81 -43.51 62.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.902 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.6 tp -56.05 -49.28 74.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.964 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.686 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.8 mt -53.18 -34.12 55.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.926 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.7 -39.1 37.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.908 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.571 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.6 t60 -56.31 -40.41 74.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.86 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.16 -40.24 89.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 64.4 mmt-85 -68.87 -38.93 80.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.854 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.571 HD12 ' HA ' ' A' ' 474' ' ' HIS . 19.6 mt -55.2 -32.33 62.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -67.28 123.93 21.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.2 m 52.41 33.89 13.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.833 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -59.17 -28.87 64.73 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.482 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -113.79 129.17 56.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.894 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 57.43 69.1 1.72 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.589 0.709 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -36.93 9.94 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 73.3 m -90.23 -63.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.865 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 166.08 -173.04 41.6 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.505 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 82.05 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.678 2.252 . . . . 0.0 112.369 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 3.1 t -112.89 132.35 55.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.867 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.0 t -92.63 137.28 32.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.888 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 CA-C-O 119.177 -0.79 . . . . 0.0 112.445 -179.954 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 14.7 t -70.55 113.3 7.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.851 0.357 . . . . 0.0 110.84 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 59.5 p -92.16 153.29 19.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.844 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -88.8 175.72 43.79 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.1 m -111.94 -175.64 2.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.89 0.376 . . . . 0.0 110.831 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.5 m -95.96 127.19 41.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -142.94 34.09 1.8 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.454 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.1 m -116.28 77.46 1.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.827 0.346 . . . . 0.0 111.128 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 98.86 141.39 12.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -102.42 56.65 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.402 . . . . 0.0 110.913 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -117.86 103.53 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 95.5 mt -145.09 107.17 4.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.444 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.6 m-85 -117.6 119.4 34.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -169.38 124.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.931 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -73.81 104.7 4.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 25.5 mtmt -84.59 -26.03 28.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.918 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -52.24 -70.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.904 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -87.41 -26.24 23.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.85 64.42 1.37 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -141.0 146.98 37.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.824 0.345 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 67.4 p -122.78 109.79 14.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.83 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.552 ' H ' HD13 ' A' ' 471' ' ' LEU . 14.6 m-85 -79.96 174.89 11.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.892 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 8.6 m -88.35 -56.62 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -77.73 131.06 37.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.826 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -62.64 -54.96 43.21 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 0.0 111.129 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.826 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.7 Cg_exo -48.01 -31.63 16.39 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.684 2.256 . . . . 0.0 112.329 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 47.8 t -82.31 -42.93 18.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.552 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.0 tp -60.1 -51.63 68.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.895 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.444 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.0 mt -53.66 -34.58 59.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.95 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 23.8 mtpt -77.99 -40.66 38.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.88 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -57.85 -32.3 67.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -66.72 -28.42 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -83.96 -34.33 24.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.9 mt -52.36 -30.59 29.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -68.59 -178.13 1.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.883 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 39.8 t -81.69 -66.05 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 70.69 126.11 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.485 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -102.37 -40.07 6.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -118.76 71.31 10.21 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.555 0.693 . . . . 0.0 110.891 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -21.22 33.9 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.681 2.254 . . . . 0.0 112.385 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.68 50.59 10.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -100.88 166.6 19.28 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.479 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 158.98 55.15 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.676 2.251 . . . . 0.0 112.353 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 19.1 m -99.42 -42.76 6.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.9 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.0 t -90.66 106.04 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.828 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.378 0 CA-C-O 119.152 -0.805 . . . . 0.0 112.514 -179.985 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 88.6 p -125.55 119.57 28.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 0.0 110.83 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.0 t -79.27 97.94 6.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 133.77 98.76 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 10.4 p -117.0 -64.37 1.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 110.869 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.6 t -158.71 113.2 2.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.885 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -78.35 118.28 4.86 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 70.9 p -122.68 30.04 6.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.817 0.341 . . . . 0.0 111.152 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -71.5 -100.24 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.518 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -66.55 164.27 16.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.901 0.381 . . . . 0.0 110.867 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.84 145.77 43.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.7 mp -108.48 97.87 7.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 472' ' ' LEU . 9.0 m-85 -71.09 132.59 45.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -178.12 119.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.7 109.72 5.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.912 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -85.94 -28.13 24.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -52.12 -73.45 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.2 p -81.79 -26.69 34.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.26 60.12 1.96 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.498 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -137.38 141.6 41.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.797 0.332 . . . . 0.0 110.9 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 64.3 p -115.01 111.22 20.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.847 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.98 151.97 28.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.6 m -70.63 -42.13 71.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 72.0 mtt-85 -87.66 113.76 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.87 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.821 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -57.82 -55.01 49.41 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.583 0.706 . . . . 0.0 111.129 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.821 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.9 Cg_exo -47.99 -37.78 30.34 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.686 2.258 . . . . 0.0 112.31 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 41.1 m -79.0 -38.77 35.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 456' ' ' TYR . 28.7 tp -53.76 -49.69 67.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.927 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.545 HD11 ' CZ ' ' A' ' 456' ' ' TYR . 5.8 mt -52.73 -34.53 53.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.93 -37.84 61.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -60.01 -39.23 85.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.874 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -62.88 -31.72 72.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.869 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 56.2 mmm-85 -79.89 -35.12 38.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.8 mt -55.77 -34.2 65.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.955 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -58.18 104.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 72.2 m -95.99 173.26 7.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.897 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -100.11 78.99 0.46 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.03 93.96 3.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.922 0.391 . . . . 0.0 110.912 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -132.4 72.11 78.58 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.594 0.711 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 -25.96 28.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.6 m -65.33 163.54 15.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.2 -175.0 25.02 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.494 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -17.17 37.73 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.694 2.262 . . . . 0.0 112.363 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 60.0 p -70.01 -48.76 56.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.861 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 26.6 m -108.68 124.97 51.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.868 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.506 -179.956 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 40.0 p -164.92 122.41 1.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.86 0.362 . . . . 0.0 110.845 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.5 p -169.34 179.73 3.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.864 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 79.6 72.7 1.18 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.464 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 20.2 m -95.55 80.98 3.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.861 0.362 . . . . 0.0 110.86 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 23.0 t -56.11 168.23 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.823 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 136.76 159.1 8.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.529 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 34.6 p -127.13 109.95 12.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.802 0.334 . . . . 0.0 111.185 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -110.07 -39.0 1.6 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.505 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -103.31 147.37 27.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.931 0.396 . . . . 0.0 110.878 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -135.82 141.95 44.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 4.9 mp -127.2 122.74 34.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.705 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.3 m-85 -67.55 118.21 10.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -168.21 113.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.912 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.14 98.32 1.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -77.22 -26.41 52.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -52.01 -69.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.874 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.6 p -89.06 -25.79 21.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.898 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 87.21 66.84 1.34 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.456 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -145.81 142.93 29.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.767 0.317 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.4 p -138.0 113.12 9.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.26 -177.53 5.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.3 t -87.88 -50.92 6.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.878 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -71.36 126.91 30.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.868 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.854 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -59.6 -55.02 50.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.576 0.703 . . . . 0.0 111.088 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.854 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.9 Cg_exo -47.91 -43.48 29.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.675 2.25 . . . . 0.0 112.342 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.26 -60.05 4.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.909 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 27.2 tp -53.86 -44.55 70.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.98 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.705 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.9 mt -59.1 -43.7 91.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -70.5 -34.26 72.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.886 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.415 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.1 t60 -61.86 -38.24 87.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.846 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.43 -28.95 70.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 26.9 mmm180 -81.87 -26.89 33.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.874 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 474' ' ' HIS . 45.0 mt -63.18 -42.39 99.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 55.5 m-70 -53.44 108.3 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.86 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.3 m -71.15 96.97 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.889 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -160.13 138.67 5.68 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -120.88 44.56 2.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.902 0.382 . . . . 0.0 110.893 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? 56.66 68.9 1.94 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.631 0.729 . . . . 0.0 110.892 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -22.24 32.24 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.676 2.25 . . . . 0.0 112.327 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.2 m -91.1 131.38 36.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 77.2 168.31 29.69 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.5 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -171.43 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.705 2.27 . . . . 0.0 112.357 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 4.6 m -133.74 120.67 20.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.833 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.8 p -111.36 55.83 0.65 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 20.1 m -133.6 -68.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.894 0.378 . . . . 0.0 110.875 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 3.2 p -98.91 -54.93 2.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -159.35 105.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.476 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 3.6 m -76.18 176.15 8.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.862 0.363 . . . . 0.0 110.852 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 57.0 m -77.2 107.7 9.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -98.47 -172.16 32.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.486 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.9 m -79.86 137.43 36.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -89.23 142.87 17.05 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.497 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -118.2 163.7 16.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.906 0.384 . . . . 0.0 110.9 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 2.6 tppp? -79.38 142.17 36.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.887 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.1 mp -111.94 93.26 4.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.957 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.633 ' CE1' HD21 ' A' ' 472' ' ' LEU . 26.0 m-85 -73.28 125.72 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.56 115.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.894 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 9.2 t -64.67 122.69 17.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -98.48 -26.02 14.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.58 -70.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.902 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -86.45 -25.77 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.38 63.05 1.82 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.46 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -140.71 136.8 32.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.772 0.32 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.9 t -108.98 111.94 23.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.878 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -80.55 144.78 32.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.5 m -67.69 -27.29 66.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.826 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 28.9 mmt-85 -100.47 105.46 16.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -52.88 -54.9 38.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.542 0.687 . . . . 0.0 111.063 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.02 -33.55 20.86 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.673 2.248 . . . . 0.0 112.361 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 3.3 t -84.73 -36.25 21.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.91 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.419 HD23 ' CB ' ' A' ' 456' ' ' TYR . 28.2 tp -54.67 -49.28 71.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.879 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.633 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.2 mt -54.15 -34.47 60.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.933 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -76.77 -30.57 56.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -66.49 -42.27 87.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.831 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.9 -27.53 67.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -47.3 76.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 29.2 mt -54.39 -44.17 72.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -53.03 125.31 16.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 75.4 m -158.28 173.63 16.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.862 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.8 84.48 0.12 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.478 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -72.54 -40.23 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.942 0.401 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? 52.73 71.39 1.46 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.693 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -19.3 36.14 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.675 2.25 . . . . 0.0 112.354 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 50.7 m -97.38 51.52 1.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.814 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 58.34 177.87 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.48 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 179.52 3.66 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.642 2.228 . . . . 0.0 112.331 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 20.0 t -89.09 94.55 9.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 11.8 p -62.9 138.36 58.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 CA-C-O 119.143 -0.81 . . . . 0.0 112.496 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.9 m -110.13 104.39 13.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.375 . . . . 0.0 110.863 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.8 p -123.31 162.36 22.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.856 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -163.75 114.4 0.6 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.49 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 57.8 m -93.83 56.17 2.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.906 0.384 . . . . 0.0 110.856 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 p -79.36 173.23 12.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.834 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 92.43 71.28 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.493 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.7 t -158.36 161.36 37.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.139 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 143.22 103.15 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.448 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -139.06 177.54 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.938 0.399 . . . . 0.0 110.847 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -152.36 138.56 18.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 62.2 mt -152.75 116.8 4.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.719 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.1 m-85 -61.36 118.26 6.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.96 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -168.49 118.4 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.921 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 6.3 t -71.03 103.93 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -81.6 -25.74 35.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -54.15 -71.45 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.7 p -83.99 -24.6 30.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.57 59.8 2.6 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -139.84 119.3 13.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.798 0.332 . . . . 0.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 21.1 t -95.58 112.21 23.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -76.3 159.01 30.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.4 t -79.22 -33.9 43.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -97.21 110.52 23.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.897 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.824 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.27 -54.98 38.96 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.598 0.714 . . . . 0.0 111.084 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.824 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -48.04 -37.81 30.81 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 0.0 112.367 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 60.7 m -78.94 -39.93 33.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.865 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.9 tp -52.52 -49.31 65.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.4 mt -52.07 -32.76 36.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -78.87 -34.33 45.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.923 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -60.94 -38.29 85.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.884 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -65.12 -27.21 68.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.854 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -81.8 -33.16 30.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.893 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 92.3 mt -57.73 -31.21 66.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.882 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 -66.04 -178.55 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.839 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.8 t -113.07 159.27 19.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.795 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.78 -65.42 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.492 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -78.85 149.59 32.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -114.85 71.9 2.69 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.547 0.689 . . . . 0.0 110.869 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -175.08 1.04 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 0.0 112.317 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 79.5 p -121.55 -34.49 3.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 105.66 169.47 23.56 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 106.4 1.66 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.681 2.254 . . . . 0.0 112.313 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 85.2 p -133.95 144.32 48.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.6 t -102.45 89.57 3.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 CA-C-O 119.141 -0.811 . . . . 0.0 112.433 -179.941 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 3.6 m -132.54 174.3 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.919 0.39 . . . . 0.0 110.829 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 23.2 m -145.56 134.86 22.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.858 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -106.67 -166.79 22.59 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.517 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -152.16 163.24 39.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.882 0.372 . . . . 0.0 110.849 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 2.6 p -173.93 134.13 0.45 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -166.54 113.1 0.53 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.495 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.8 t -158.84 142.71 15.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.369 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -70.05 119.66 8.98 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.459 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -90.9 165.85 13.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.37 151.49 8.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.5 mp -143.94 108.58 4.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.751 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.4 m-85 -86.84 124.82 33.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.929 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -176.83 122.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.2 126.5 32.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.859 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -105.2 -27.13 11.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -52.47 -44.41 65.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.875 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.0 p -115.79 -24.73 8.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 84.21 68.73 1.39 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.49 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 21.4 mtmm -139.8 126.85 20.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.775 0.322 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.3 p -124.65 91.74 3.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.88 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -69.14 -176.64 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -92.45 -35.14 13.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.867 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -83.89 144.07 29.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.847 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.852 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -74.42 -54.94 2.96 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.57 0.7 . . . . 0.0 111.083 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.6 Cg_exo -48.01 -57.03 2.58 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.3 t -52.02 -54.44 29.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 26.9 tp -56.17 -43.91 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.751 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -59.61 -61.09 2.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -56.34 -33.17 65.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -61.47 -44.33 97.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.836 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -56.75 -25.56 55.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 38.5 mtt180 -78.59 -28.73 45.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.84 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.4 mt -52.19 -46.21 65.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -69.25 105.45 2.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.848 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 4.1 m -59.57 152.94 20.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.837 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -106.17 -40.03 2.02 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.513 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -62.88 97.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.901 0.381 . . . . 0.0 110.923 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -138.89 69.64 43.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.592 0.71 . . . . 0.0 110.923 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 156.81 62.37 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.636 2.224 . . . . 0.0 112.352 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -123.09 125.94 46.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -82.0 177.66 53.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.528 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -36.08 11.39 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.709 2.272 . . . . 0.0 112.322 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 30.4 t -85.16 112.29 20.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 8.3 m -158.3 132.34 7.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.849 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.464 -179.964 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 31.3 t -71.66 117.12 12.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.834 0.35 . . . . 0.0 110.85 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.6 m -53.02 -53.84 44.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 167.87 -127.03 1.49 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.486 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 73.1 m -150.04 -178.98 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.373 . . . . 0.0 110.85 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.6 m -123.75 -68.03 0.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.897 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 90.53 66.99 1.19 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 11.9 t -156.39 166.74 32.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 111.156 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 106.61 86.67 1.9 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.484 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -61.19 -177.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.922 0.391 . . . . 0.0 110.904 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -55.79 144.55 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 18.6 mt -99.85 104.76 16.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.726 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.2 m-85 -67.96 126.41 29.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.954 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . 0.566 ' HA ' HD21 ' A' ' 471' ' ' LEU . 5.8 t30 -177.15 126.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.9 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 11.1 t -76.9 115.55 16.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -95.56 -26.14 15.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -53.19 -69.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 18.4 p -87.61 -25.51 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.84 56.63 2.87 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.507 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.1 mttm -141.48 111.4 6.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 17.4 m -92.71 112.17 24.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.883 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.497 ' H ' HD13 ' A' ' 471' ' ' LEU . 12.2 m-85 -70.93 -176.87 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.901 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.7 p -80.7 -73.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.82 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.43 164.05 14.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.831 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -80.72 -54.54 0.76 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.602 0.715 . . . . 0.0 111.111 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.831 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 64.4 Cg_exo -48.06 -54.31 5.41 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.686 2.257 . . . . 0.0 112.355 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 18.9 p -55.04 -26.51 37.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 457' ' ' ASN . 20.5 tp -82.48 -45.41 14.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.919 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.726 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -57.15 -28.54 62.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -88.34 -42.99 11.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.622 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.5 t60 -51.96 -35.36 45.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.42 -47.01 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 32.1 mtt85 -73.7 -31.73 63.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 474' ' ' HIS . 35.3 mt -53.15 -31.4 42.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -63.42 104.95 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.829 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 86.8 p -96.66 126.27 41.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.836 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -79.64 -30.87 42.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.48 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 62.67 33.29 15.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.893 0.378 . . . . 0.0 110.868 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 43.7 mttm 57.42 71.88 1.02 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 0.0 110.878 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 178.32 4.73 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.645 2.23 . . . . 0.0 112.351 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 27.1 t -158.51 159.24 35.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -68.2 -72.31 0.83 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.512 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 162.36 42.41 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.664 2.243 . . . . 0.0 112.36 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 11.0 m -93.73 128.69 40.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.879 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.8 p -76.02 79.21 2.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.171 -0.794 . . . . 0.0 112.48 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 2.8 t -125.15 125.36 43.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.927 0.394 . . . . 0.0 110.864 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 13.9 m -80.32 174.72 11.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.845 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -154.36 38.39 0.67 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.466 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 7.5 m -99.06 128.35 45.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.4 p -161.51 -178.45 6.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 93.34 52.64 1.99 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.468 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.5 m -103.5 88.59 3.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -147.77 118.16 0.97 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.474 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -101.57 152.95 20.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.882 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -99.59 44.4 1.02 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.46 97.55 0.21 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.926 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.707 ' CE1' HD21 ' A' ' 472' ' ' LEU . 12.7 m-85 -70.49 114.17 8.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.922 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -163.26 118.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.876 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.3 t -71.08 126.81 30.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -107.03 -27.65 10.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -52.5 -50.54 62.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.843 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.2 p -110.62 -24.77 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.4 75.21 1.24 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -153.04 138.06 17.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.806 0.336 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.8 p -132.08 111.8 11.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.823 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.13 173.48 11.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.909 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 95.9 p -85.07 -27.95 25.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -92.77 116.99 29.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.882 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -53.08 -54.74 41.03 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.591 0.71 . . . . 0.0 111.116 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 55.5 Cg_exo -48.3 -51.16 10.62 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.322 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.7 m -57.46 -48.28 79.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 22.2 tp -60.64 -49.42 77.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.707 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -56.34 -40.0 73.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.91 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -74.4 -26.38 60.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.896 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.52 -35.65 73.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.829 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -66.72 -29.02 68.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -61.94 -48.52 80.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -51.93 -50.12 61.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -52.37 114.99 1.53 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.5 t -86.74 124.52 33.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.85 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -169.79 34.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.469 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -118.56 97.35 5.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 0.0 110.874 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -167.82 70.89 0.9 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.699 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 104.48 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.709 2.273 . . . . 0.0 112.354 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 5.2 t -107.54 145.3 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 171.6 -178.48 43.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.489 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 128.97 16.81 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.73 2.286 . . . . 0.0 112.369 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 63.1 m -74.5 -176.92 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.8 t -170.42 171.83 6.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.854 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 CA-C-O 119.077 -0.846 . . . . 0.0 112.484 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.491 -0.243 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.4 m 54.57 29.59 11.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.856 0.36 . . . . 0.0 110.888 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 71.5 m -79.15 -36.53 40.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.854 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -82.59 -174.54 50.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.525 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 50.3 m -107.3 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.845 0.355 . . . . 0.0 110.793 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 31.3 p -133.97 -61.06 0.8 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.905 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -81.48 79.54 1.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.463 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.0 m -100.1 -37.2 9.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.859 0.361 . . . . 0.0 111.165 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -98.19 103.22 2.77 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -122.89 85.89 2.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.925 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 174.39 11.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 24.5 mt 51.85 46.76 26.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.671 ' CE1' HD11 ' A' ' 472' ' ' LEU . 30.9 m-85 -58.44 120.59 9.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.944 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -160.39 131.49 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -85.92 86.33 7.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -71.28 -24.01 62.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.921 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -51.92 -72.12 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.858 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 17.4 p -90.7 -25.45 20.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 88.93 55.38 2.14 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.532 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -127.84 103.7 7.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 0.0 110.952 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 39.0 t -87.84 112.81 22.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -89.89 149.53 22.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.3 m -72.8 -39.93 66.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.836 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -87.15 102.43 14.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.893 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -51.77 -54.83 35.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 0.0 111.139 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.3 Cg_exo -47.98 -29.35 11.79 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 0.0 112.358 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 1.4 m -92.34 -32.54 14.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.881 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.421 HD23 ' HB2' ' A' ' 456' ' ' TYR . 25.6 tp -55.95 -48.37 75.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.968 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.671 HD11 ' CE1' ' A' ' 456' ' ' TYR . 7.5 mt -51.87 -36.43 48.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.922 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -38.59 72.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.898 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -61.15 -34.93 75.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.862 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.45 -35.68 78.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -63.12 -31.68 72.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -52.02 -32.17 32.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -93.52 104.14 16.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.866 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.7 m -71.66 179.72 2.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.871 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 163.07 -62.97 0.26 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.496 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -125.98 29.74 5.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.927 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -148.9 71.72 10.37 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.559 0.695 . . . . 0.0 110.861 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 90.68 0.51 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 0.0 112.367 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 13.7 p -68.74 -177.65 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.1 -75.02 0.84 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.487 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 160.7 48.72 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.712 2.275 . . . . 0.0 112.302 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.7 t -145.04 150.57 37.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.853 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 93.7 p -120.52 35.88 4.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 119.163 -0.799 . . . . 0.0 112.46 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 59.4 p -171.92 177.72 3.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.896 0.379 . . . . 0.0 110.847 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 27.2 t -106.98 -70.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.813 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 134.65 50.39 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.456 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 4.4 m -95.75 99.5 11.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.875 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.1 t -139.98 160.0 40.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.82 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 98.69 104.04 2.43 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.418 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 p -71.86 171.34 11.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.121 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -131.29 52.23 0.83 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.501 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -138.78 175.75 9.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.0 110.87 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 18.5 tttp -123.1 161.88 23.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 55.1 mt -136.41 107.08 6.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.703 ' CE1' HD21 ' A' ' 472' ' ' LEU . 8.7 m-85 -64.27 122.72 17.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -174.46 118.73 0.22 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.96 136.58 52.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -112.95 -29.63 7.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.901 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -52.6 -56.79 12.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.898 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 32.1 p -99.37 -28.74 13.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.896 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.14 56.8 2.63 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -134.94 117.76 16.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.319 . . . . 0.0 110.864 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.8 p -93.61 107.36 19.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.856 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.432 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.0 m-85 -71.4 158.07 36.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 6.5 p -75.39 -31.6 60.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.885 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 18.4 mtt-85 -98.88 138.62 35.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.84 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -69.29 -54.97 10.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.538 0.685 . . . . 0.0 111.103 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.5 Cg_exo -48.04 -55.05 4.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.666 2.244 . . . . 0.0 112.33 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.5 m -59.01 -40.59 85.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.882 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.432 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.1 tp -59.79 -50.62 73.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.703 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.9 mt -52.75 -44.83 66.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.947 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -70.76 -36.83 73.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -58.87 -38.48 78.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -62.66 -29.51 70.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.839 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -78.48 -33.25 48.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 71.4 mt -52.07 -39.86 60.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -67.87 116.71 8.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.883 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 43.8 m -138.08 170.77 15.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -98.76 -23.87 11.45 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.517 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -67.55 128.9 38.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -136.01 160.64 66.48 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 -17.14 37.86 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.626 2.217 . . . . 0.0 112.36 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 4.1 p -133.98 107.27 7.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.86 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -75.74 175.89 51.38 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.428 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -172.03 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.67 2.246 . . . . 0.0 112.359 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 35.4 m -135.96 86.85 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.866 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.6 t -94.96 137.85 33.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.873 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 CA-C-O 119.107 -0.83 . . . . 0.0 112.506 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 6.4 t -149.54 112.18 4.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.888 0.375 . . . . 0.0 110.828 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 7.0 t -133.09 138.39 46.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -179.78 -123.91 0.86 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.471 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 9.1 p -130.92 144.93 51.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.835 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 44.4 m -140.03 179.58 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 66.07 83.99 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.7 m -93.63 119.44 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.837 0.351 . . . . 0.0 111.129 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -67.72 128.2 26.34 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.512 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -133.19 139.55 47.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.897 0.379 . . . . 0.0 110.898 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . 0.429 ' C ' HD12 ' A' ' 455' ' ' LEU . 0.1 OUTLIER -97.21 135.9 38.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.429 HD12 ' C ' ' A' ' 454' ' ' LYS . 6.2 mp -135.19 116.3 14.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.939 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.502 ' CE1' HD21 ' A' ' 472' ' ' LEU . 7.9 m-85 -78.19 114.3 16.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.924 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -161.27 121.64 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.901 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 8.8 t -70.37 136.31 49.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -111.78 -29.56 7.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.9 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -53.8 -55.81 23.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 21.8 p -101.48 -26.09 13.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.901 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.67 57.84 3.0 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.458 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -135.81 120.8 18.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 2.9 t -91.86 109.03 20.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.896 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -77.46 151.09 34.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.862 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 23.1 t -66.99 -55.9 12.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -74.0 117.79 16.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.879 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.82 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.12 -54.99 44.13 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.568 0.699 . . . . 0.0 111.111 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.82 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 61.1 Cg_exo -47.98 -55.27 4.17 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.706 2.271 . . . . 0.0 112.348 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 99.6 m -56.4 -45.17 80.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 25.1 tp -52.46 -48.1 66.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.502 HD21 ' CE1' ' A' ' 456' ' ' TYR . 5.0 mt -53.18 -35.82 60.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -78.96 -34.92 43.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.687 ' HA ' HD12 ' A' ' 477' ' ' LEU . 80.4 t60 -60.97 -38.91 87.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.862 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -63.7 -34.21 77.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.921 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 31.6 mtt85 -81.13 -34.62 32.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.877 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 474' ' ' HIS . 28.4 mt -55.01 -32.52 61.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 36.1 m-70 -60.01 -69.88 0.19 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.854 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 26.5 p -56.47 156.27 6.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -75.54 126.81 8.74 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.459 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -128.45 29.23 5.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.907 0.384 . . . . 0.0 110.891 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -137.0 160.67 65.23 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.585 0.707 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -23.92 30.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 0.0 112.325 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 56.3 p -72.86 -35.71 67.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.12 174.78 38.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.52 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -24.14 29.62 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.666 2.244 . . . . 0.0 112.315 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 15.6 m -92.03 96.8 10.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.803 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 61.8 p -84.36 176.09 8.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.864 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.179 -0.79 . . . . 0.0 112.478 179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 50.8 m -89.97 -45.92 8.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.843 0.354 . . . . 0.0 110.82 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -101.15 157.83 16.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -104.0 -99.95 2.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.476 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 6.0 m -119.58 143.34 47.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.867 0.365 . . . . 0.0 110.843 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 60.6 p -172.43 121.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 143.84 79.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.467 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 7.6 t -164.05 126.94 2.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -173.09 38.17 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.49 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -95.81 138.05 34.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.973 0.416 . . . . 0.0 110.843 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -87.16 107.83 18.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 10.4 mt -77.92 100.97 6.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.617 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.3 m-85 -65.21 119.58 11.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . 0.444 ' HA ' HD21 ' A' ' 471' ' ' LEU . 41.3 t30 -169.58 117.33 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.87 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 25.3 t -65.06 136.58 56.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -112.34 -27.87 8.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -54.18 -50.92 65.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.896 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.1 p -108.46 -26.24 10.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.52 67.0 1.59 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -143.4 128.88 19.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.802 0.334 . . . . 0.0 110.873 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 5.0 t -100.67 110.41 22.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.861 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -78.42 155.45 29.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.897 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 19.9 m -64.56 -59.35 4.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.861 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -76.37 124.2 27.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.843 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.819 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -60.56 -55.01 49.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.569 0.699 . . . . 0.0 111.089 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 60.8 Cg_exo -47.94 -42.51 31.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.661 2.241 . . . . 0.0 112.356 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 4.9 m -67.91 -43.19 79.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.444 HD21 ' HA ' ' A' ' 457' ' ' ASN . 25.8 tp -55.2 -45.15 75.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.95 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.617 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.3 mt -56.57 -26.66 55.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -86.36 -29.26 23.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.859 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.21 -37.25 83.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.862 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -62.3 -27.54 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -79.45 -32.71 42.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 88.5 mt -52.2 -43.32 64.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -62.91 -176.55 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.821 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.7 p 54.93 29.75 12.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.69 144.42 15.55 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.465 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -135.77 133.74 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 110.856 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -79.58 160.69 69.22 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 110.885 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 85.94 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 0.0 112.372 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 29.2 m -96.72 69.74 2.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.852 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 155.07 174.09 24.58 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 179.56 3.6 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.707 2.272 . . . . 0.0 112.319 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 2.2 t -56.51 138.94 50.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.9 m -89.15 141.74 28.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.472 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 t -89.01 151.08 22.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.846 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.7 m -109.28 -31.98 7.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.835 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 129.94 -92.02 0.31 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.3 p -146.36 177.2 9.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.935 0.398 . . . . 0.0 110.79 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 39.9 t -87.84 92.96 9.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.887 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 64.95 -102.69 0.67 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m 57.42 28.22 15.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.87 0.367 . . . . 0.0 111.178 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -108.9 179.83 21.27 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.507 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -136.4 171.2 14.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.895 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -120.65 138.42 53.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 46.4 mt -96.61 108.59 21.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.89 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.624 ' CE1' HD21 ' A' ' 472' ' ' LEU . 13.6 m-85 -81.27 127.97 33.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -176.77 134.94 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.5 t -82.81 140.49 32.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.74 -25.95 8.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -56.88 -61.23 2.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.8 p -99.71 -25.61 14.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.56 62.69 2.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.474 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -133.95 113.71 12.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.816 0.341 . . . . 0.0 110.864 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 8.1 p -89.37 101.62 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.85 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.53 164.76 20.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.948 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 t -77.27 -48.2 18.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -83.0 145.28 29.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.868 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.808 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -79.01 -54.95 0.98 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.528 0.68 . . . . 0.0 111.066 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.808 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 62.2 Cg_exo -47.99 -49.72 13.32 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.693 2.262 . . . . 0.0 112.308 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 86.4 m -64.61 -44.45 90.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.92 -49.58 65.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.909 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.624 HD21 ' CE1' ' A' ' 456' ' ' TYR . 6.2 mt -55.09 -28.25 51.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 10.4 mmtm -81.02 -34.16 33.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -62.76 -46.07 89.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.901 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -57.27 -26.1 60.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -82.94 -37.04 24.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.847 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.25 -34.92 64.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -61.3 116.23 4.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 30.9 t -69.25 158.6 34.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.855 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -141.4 -68.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.48 116.02 10.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 33.3 mttm -70.26 160.68 80.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.587 0.708 . . . . 0.0 110.924 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 158.62 56.28 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.631 2.221 . . . . 0.0 112.345 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 1.1 t -100.79 93.9 5.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 76.68 -173.24 54.61 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.482 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -47.44 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.238 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 34.7 t -95.82 165.08 12.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.884 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 57.8 m -53.63 160.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.803 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 119.142 -0.81 . . . . 0.0 112.459 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 43.2 t -120.45 123.23 42.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.907 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.8 t -117.71 -61.44 1.69 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -75.73 102.25 1.5 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.519 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 42.8 t -63.68 159.96 17.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.839 0.352 . . . . 0.0 110.922 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 77.7 p -87.69 126.48 35.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.854 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -141.59 132.91 5.5 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 30.5 p -132.62 73.74 1.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.346 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -151.42 -149.28 5.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.498 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -134.45 117.02 15.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.928 0.394 . . . . 0.0 110.904 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -163.05 175.84 10.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 58.7 mt 58.45 51.79 7.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.646 ' CE1' HD11 ' A' ' 472' ' ' LEU . 28.7 m-85 -60.99 119.63 8.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.926 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -159.75 128.72 5.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.893 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 13.6 t -80.12 128.72 33.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.88 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -109.22 -24.41 11.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.874 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -54.31 -52.57 61.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.3 p -108.1 -26.22 10.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.894 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.6 59.19 1.84 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.514 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -137.31 121.96 18.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.775 0.321 . . . . 0.0 110.877 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 51.8 m -100.02 100.16 11.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.417 ' H ' HD13 ' A' ' 471' ' ' LEU . 17.7 m-85 -68.93 149.76 48.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.1 t -66.54 -43.64 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -87.21 128.37 35.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.841 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -65.96 -54.96 24.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.599 0.714 . . . . 0.0 111.141 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.5 Cg_exo -47.98 -39.05 32.44 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.333 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 15.2 m -76.2 -35.36 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.879 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.417 HD13 ' H ' ' A' ' 465' ' ' PHE . 24.5 tp -61.96 -50.62 71.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.646 HD11 ' CE1' ' A' ' 456' ' ' TYR . 5.4 mt -52.61 -36.14 55.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.894 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 22.0 mtpp -77.25 -29.56 54.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.894 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -66.41 -34.7 78.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.08 -26.9 67.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -73.0 -38.2 66.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 80.8 mt -53.69 -33.07 54.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -71.86 122.07 20.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 11.2 t -90.76 63.98 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -109.15 -78.96 1.08 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.517 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -107.17 127.12 53.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.929 0.395 . . . . 0.0 110.871 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -137.89 160.65 63.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.564 0.697 . . . . 0.0 110.896 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 177.43 5.57 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 0.0 112.363 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 6.1 t -104.51 143.61 32.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.832 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -166.96 -74.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.504 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 101.13 0.87 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.668 2.245 . . . . 0.0 112.336 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 7.6 t -132.75 -177.13 4.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 43.8 t -56.43 125.92 24.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.499 -179.956 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 37.0 m -94.92 142.63 27.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.925 0.393 . . . . 0.0 110.863 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 6.4 m -158.89 163.01 36.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . 177.77 138.02 2.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.518 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 14.8 m -163.07 145.21 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.94 0.4 . . . . 0.0 110.804 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.6 m -155.7 117.15 3.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 158.1 126.15 0.87 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.462 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 50.2 p -115.1 171.12 7.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.816 0.341 . . . . 0.0 111.121 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . 85.41 142.12 6.03 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.511 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -115.6 26.39 10.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 110.891 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . 0.452 ' O ' HD23 ' A' ' 455' ' ' LEU . 0.0 OUTLIER -95.12 141.32 28.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.904 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 454' ' ' LYS . 36.3 mt -148.84 82.0 1.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.519 ' CE1' HD21 ' A' ' 472' ' ' LEU . 10.6 m-85 -122.56 128.87 51.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . 0.481 ' HA ' HD21 ' A' ' 471' ' ' LEU . 48.5 t30 -171.29 121.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 12.0 t -62.35 125.69 24.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.87 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 21.8 mttp -103.93 -26.5 12.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.863 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.71 -66.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 19.7 p -92.12 -26.09 18.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.853 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.0 72.97 1.28 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.465 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -149.9 138.24 20.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.782 0.325 . . . . 0.0 110.967 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 4.1 t -111.93 110.07 20.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.856 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.593 ' H ' HD13 ' A' ' 471' ' ' LEU . 11.3 m-85 -76.02 173.91 10.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.861 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.6 p -89.77 -35.8 15.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.87 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -95.44 113.87 25.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -55.26 -54.98 44.6 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.712 . . . . 0.0 111.071 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.8 Cg_exo -48.01 -29.6 12.37 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.709 2.273 . . . . 0.0 112.312 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 79.8 m -89.34 -34.85 16.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.852 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.593 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.8 tp -58.59 -40.31 82.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' A' ' 456' ' ' TYR . 4.3 mt -61.39 -42.86 99.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.95 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -68.05 -43.23 79.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.861 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.775 ' HA ' HD12 ' A' ' 477' ' ' LEU . 74.1 t60 -56.15 -39.01 71.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -65.63 -29.04 69.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -78.35 -32.43 49.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 474' ' ' HIS . 22.2 mt -53.14 -43.86 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.914 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.87 100.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 37.1 t -66.7 -64.13 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.19 177.74 20.4 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.427 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -109.67 155.73 21.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.878 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 55.4 mttt 57.04 70.39 1.4 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.551 0.691 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 156.17 64.07 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.736 2.29 . . . . 0.0 112.336 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 18.1 t -113.79 118.3 33.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 145.64 -170.49 26.9 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.467 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 109.92 2.42 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.71 2.273 . . . . 0.0 112.354 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 5.9 t -73.33 112.09 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 22.1 t -96.66 140.26 31.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.533 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.476 -0.25 . . . . 0.0 112.476 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 30.7 t -132.26 94.3 3.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.854 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.1 m -133.61 65.25 1.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.835 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.37 58.61 0.25 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.475 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 32.5 m -96.78 101.05 12.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 110.865 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.3 t -65.17 148.38 51.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.85 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . 159.19 167.49 19.94 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.536 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 9.0 t -171.66 150.18 2.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -76.54 -57.26 3.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.48 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -102.36 122.75 44.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.906 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -99.58 164.37 12.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.863 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 455' ' ' LEU . 4.3 mm? -74.16 99.79 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.915 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.653 ' CE1' HD21 ' A' ' 472' ' ' LEU . 20.6 m-85 -76.12 118.8 19.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.942 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -164.96 117.76 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 7.7 t -68.36 93.82 0.5 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.845 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -71.74 -26.44 62.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.86 -74.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.847 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 22.9 p -82.07 -26.5 33.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.864 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 86.81 55.1 2.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.465 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -128.27 144.18 51.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.891 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 1.2 m -119.51 91.48 3.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.866 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -62.59 153.3 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.894 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 1.7 p -75.29 -29.69 60.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.838 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -98.79 112.85 24.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.877 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.816 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -56.83 -55.0 48.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 0.0 111.119 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.816 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.3 Cg_exo -48.0 -43.27 30.63 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.735 2.29 . . . . 0.0 112.366 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 34.1 m -73.49 -36.89 65.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.2 -48.21 76.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.653 HD21 ' CE1' ' A' ' 456' ' ' TYR . 8.1 mt -54.42 -30.08 51.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -82.12 -32.95 29.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.949 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 477' ' ' LEU . 81.0 t60 -64.59 -41.8 96.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -60.39 -28.29 68.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.865 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 27.5 mmm-85 -84.61 -31.33 24.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 474' ' ' HIS . 48.4 mt -57.05 -35.35 69.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -58.73 101.3 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 1.8 t -143.4 140.89 30.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -102.97 -107.23 3.13 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.476 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -112.24 -45.94 3.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 0.0 110.848 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mttt -140.54 160.68 58.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.584 0.707 . . . . 0.0 110.873 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -27.82 26.22 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.648 2.232 . . . . 0.0 112.375 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 3.4 m -97.46 160.9 14.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -86.58 176.12 47.8 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.515 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.78 163.52 37.98 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.673 2.249 . . . . 0.0 112.324 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 1.7 m -158.37 124.93 4.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.899 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.9 p -108.22 167.62 9.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.867 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 CA-C-O 119.106 -0.83 . . . . 0.0 112.473 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 4.9 t -82.47 107.82 15.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 0.0 110.884 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 14.0 p -133.9 -42.93 0.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.846 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -64.98 113.48 5.91 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.471 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 59.6 p -99.34 128.66 45.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -111.44 37.54 2.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -91.3 77.07 1.42 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.509 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 43.4 p -106.01 108.33 19.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.344 . . . . 0.0 111.141 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -73.82 -33.69 57.34 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.504 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.82 161.92 30.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -129.03 158.9 37.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.824 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 455' ' ' LEU . 4.3 mm? -80.75 100.64 8.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.727 ' CE1' HD21 ' A' ' 472' ' ' LEU . 15.3 m-85 -54.02 132.77 43.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.9 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.84 139.01 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 10.3 t -88.34 133.55 34.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -116.31 -25.98 7.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.917 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -53.4 -55.81 21.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.874 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 23.4 p -100.53 -26.51 13.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.908 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.35 38.91 6.52 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.517 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -128.87 104.08 7.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.859 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 83.9 p -89.06 110.8 21.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.792 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.537 ' H ' HD13 ' A' ' 471' ' ' LEU . 29.9 m-85 -68.58 -176.59 0.81 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 2.5 m -118.72 28.25 8.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -130.98 156.19 45.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.878 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.818 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -78.46 -55.6 1.05 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.586 0.707 . . . . 0.0 111.117 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.818 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 54.1 Cg_endo -76.84 -42.83 0.29 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 0.0 112.332 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -59.46 -29.05 67.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.861 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.537 HD13 ' H ' ' A' ' 465' ' ' PHE . 21.7 tp -82.72 -52.82 6.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.89 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.727 HD21 ' CE1' ' A' ' 456' ' ' TYR . 7.1 mt -57.98 -25.75 61.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -86.02 -45.53 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -52.28 -38.41 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.877 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.19 -28.9 56.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -76.93 -31.4 56.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 90.7 mt -52.09 -30.79 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.909 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.48 -177.72 6.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.848 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 3.8 t -98.95 172.33 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 129.94 71.83 0.12 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -106.84 85.23 2.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.893 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 37.7 tptt 52.4 71.88 1.34 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.555 0.693 . . . . 0.0 110.878 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 159.95 51.55 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.655 2.236 . . . . 0.0 112.373 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 19.5 m -70.7 -30.55 67.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 141.2 174.17 14.06 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.501 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 110.44 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.631 2.221 . . . . 0.0 112.368 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 13.6 p -121.37 55.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.873 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.4 p -134.32 154.28 51.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.871 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-O 119.149 -0.806 . . . . 0.0 112.506 -179.977 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' SER . . . . . . . . . . . . . 1.2 m 62.32 33.93 16.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 0.0 110.855 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 79.2 p -120.99 119.22 31.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' GLY . . . . . . . . . . . . . . . -165.38 96.03 0.13 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.494 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' SER . . . . . . . . . . . . . 2.7 t -57.78 114.81 2.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.833 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 40.4 t -95.16 53.64 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.883 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . -109.13 22.79 24.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.507 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -108.77 99.64 8.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 111.102 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' GLY . . . . . . . . . . . . . . . -134.66 46.34 1.05 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.455 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -91.9 174.48 7.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 110.892 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -140.06 150.67 44.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 5.5 mp -126.92 116.63 21.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' TYR . . . . . 0.401 ' CB ' HD23 ' A' ' 471' ' ' LEU . 14.6 m-85 -78.26 122.3 25.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.926 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -165.49 132.38 2.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . . . . . . . . . 43.7 t -75.82 137.28 40.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -112.32 -27.0 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -54.5 -60.79 2.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.892 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' CYS . . . . . . . . . . . . . 20.5 p -96.97 -26.38 15.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 85.41 63.88 1.54 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.429 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -140.73 164.01 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.839 0.352 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' SER . . . . . . . . . . . . . 22.1 t -134.57 117.58 16.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . 0.459 ' H ' HD13 ' A' ' 471' ' ' LEU . 19.9 m-85 -84.23 160.42 20.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.855 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 t -74.86 -41.01 60.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.832 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -91.23 127.84 36.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ALA . . . . . 0.813 ' HB3' ' HD3' ' A' ' 469' ' ' PRO . . . -63.22 -54.95 40.7 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.616 0.722 . . . . 0.0 111.129 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.813 ' HD3' ' HB3' ' A' ' 468' ' ' ALA . 59.0 Cg_exo -47.91 -42.56 31.26 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.718 2.279 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' CYS . . . . . . . . . . . . . 68.8 m -71.9 -39.2 69.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.459 HD13 ' H ' ' A' ' 465' ' ' PHE . 27.3 tp -58.8 -52.03 67.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.956 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.4 mt -52.08 -33.3 38.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.937 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 40.2 mtpt -79.14 -36.02 41.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.921 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -59.48 -36.12 75.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.873 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -63.08 -29.16 70.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 20.3 mmm180 -84.14 -32.86 24.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.88 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 34.8 mt -55.61 -28.02 52.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.88 118.88 12.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.891 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 34.2 t -116.68 -72.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -164.57 77.13 0.15 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.454 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -105.79 145.8 30.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 0.0 110.849 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -133.77 157.58 77.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.54 0.686 . . . . 0.0 110.861 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 79.75 0.93 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.665 2.243 . . . . 0.0 112.326 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' SER . . . . . . . . . . . . . 17.3 m -157.92 163.65 37.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.896 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . 160.74 171.03 26.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.52 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 120.65 7.41 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.666 2.244 . . . . 0.0 112.378 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 12.7 p -101.04 89.94 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 58.4 m -91.09 164.29 13.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.838 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.505 179.948 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_