data_2k9d_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 2k9d _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 ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 3.04 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 2.02 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.786 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 3.23 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.633 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.8100000000000001 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 2.0800000000000001 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 463' ' ' VAL . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 2.0800000000000001 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 2.2599999999999998 110.499 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.658 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 3.4100000000000001 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.46 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4900000000000002 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 6.0999999999999996 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.496 ' HG ' ' H ' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.75 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.561 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.4700000000000002 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.507 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.6299999999999999 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 3.5699999999999998 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.71 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.8099999999999996 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . 0.488 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 3.21 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 3.21 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.633 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 5.3600000000000003 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.8199999999999998 110.609 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.7200000000000002 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.535 ' HA ' HG12 ' A' ' 488' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.6400000000000001 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.8599999999999999 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 485' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.2799999999999998 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.6299999999999999 111.319 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 1.4399999999999999 111.26 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.76 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.8700000000000001 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.786 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 2.29 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 1.29 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 3.3300000000000001 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 2.2000000000000002 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 2.4199999999999999 109.024 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 3.1600000000000001 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.546 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.9399999999999999 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.5699999999999998 112.52 -173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.6499999999999999 110.248 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 3.0099999999999998 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 2.2799999999999998 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.48 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.73 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 3.04 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 2.02 110.891 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 3.23 110.869 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.8100000000000001 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 2.0800000000000001 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 2.0800000000000001 111.163 177.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.859 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 2.2599999999999998 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 3.4100000000000001 110.825 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.46 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4900000000000002 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 6.0999999999999996 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.75 107.945 170.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.4700000000000002 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.44 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.6299999999999999 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.455 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 3.5699999999999998 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.859 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.71 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.8099999999999996 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . 0.455 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 3.21 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 3.21 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 5.3600000000000003 110.505 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.8199999999999998 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.475 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.7200000000000002 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.624 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.6400000000000001 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.8599999999999999 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.624 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.2799999999999998 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.6299999999999999 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.494 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 1.4399999999999999 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.76 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.8700000000000001 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 2.29 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 1.29 110.053 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 3.3300000000000001 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 2.2000000000000002 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 2.4199999999999999 109.1 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 503' ' ' LYS . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 3.1600000000000001 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.411 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.9399999999999999 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.56 ' O ' HG21 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.5699999999999998 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.6499999999999999 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 3.0099999999999998 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.56 HG21 ' O ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 2.2799999999999998 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.73 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 3.04 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.631 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 2.02 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.616 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 3.23 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.406 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.8100000000000001 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 2.0800000000000001 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 2.0800000000000001 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.539 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 2.2599999999999998 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.449 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 3.4100000000000001 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.46 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4900000000000002 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . 0.652 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 6.0999999999999996 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.765 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.75 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.765 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.4700000000000002 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.672 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.6299999999999999 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.627 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 3.5699999999999998 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.672 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.71 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.8099999999999996 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . 0.627 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 3.21 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 3.21 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 5.3600000000000003 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.8199999999999998 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.718 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.6400000000000001 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . 0.406 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.8599999999999999 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.718 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.2799999999999998 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.6299999999999999 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.573 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 1.4399999999999999 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.76 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.8700000000000001 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 2.29 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 1.29 109.823 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 3.3300000000000001 110.257 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 2.2000000000000002 110.193 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.616 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 2.4199999999999999 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 3.1600000000000001 109.566 172.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.9399999999999999 110.445 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.599 ' O ' HG21 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.5699999999999998 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.6499999999999999 109.661 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 3.0099999999999998 111.151 175.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.599 HG21 ' O ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 2.2799999999999998 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 501' ' ' LEU . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.73 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 3.04 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 2.02 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.521 ' O ' HG13 ' A' ' 468' ' ' ILE . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 3.23 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.8100000000000001 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 2.0800000000000001 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 2.0800000000000001 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.799 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 2.2599999999999998 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 3.4100000000000001 110.536 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.46 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.501 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4900000000000002 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 6.0999999999999996 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.75 111.198 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.4700000000000002 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.469 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.6299999999999999 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.541 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 3.5699999999999998 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.799 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.71 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . 0.469 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.8099999999999996 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 3.21 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.504 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 3.21 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.593 ' HB3' HD13 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 5.3600000000000003 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.8199999999999998 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.7200000000000002 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.668 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.6400000000000001 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.8599999999999999 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.668 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.2799999999999998 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.485 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.6299999999999999 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.425 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 1.4399999999999999 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.76 113.853 -166.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.8700000000000001 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 2.29 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.29 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 3.3300000000000001 110.298 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 2.2000000000000002 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 2.4199999999999999 109.013 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 3.1600000000000001 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.61 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.9399999999999999 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.5699999999999998 111.486 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.6499999999999999 110.633 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 3.0099999999999998 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 500' ' ' MET . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 2.2799999999999998 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.73 112.777 -177.358 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 3.04 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 2.02 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 3.23 110.861 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.8100000000000001 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 2.0800000000000001 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 2.0800000000000001 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 2.2599999999999998 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 3.4100000000000001 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.46 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4900000000000002 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 6.0999999999999996 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.531 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.75 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.561 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.4700000000000002 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.6299999999999999 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 3.5699999999999998 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.71 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.8099999999999996 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 3.21 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 3.21 111.816 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.489 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 5.3600000000000003 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.8199999999999998 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.7200000000000002 110.582 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.489 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.6400000000000001 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.8599999999999999 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.46 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.2799999999999998 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.6299999999999999 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 1.4399999999999999 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.76 110.447 176.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.8700000000000001 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 2.29 111.598 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 1.29 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 3.3300000000000001 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 500' ' ' MET . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 2.2000000000000002 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 2.4199999999999999 109.752 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 3.1600000000000001 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.52 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.9399999999999999 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.5699999999999998 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.6499999999999999 110.262 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 3.0099999999999998 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 2.2799999999999998 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.73 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 3.04 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 2.02 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.413 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 3.23 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.8100000000000001 110.74 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 2.0800000000000001 110.756 -177.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 2.0800000000000001 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 2.2599999999999998 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.688 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 3.4100000000000001 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.46 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4900000000000002 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 6.0999999999999996 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.693 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.75 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.693 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.4700000000000002 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.6299999999999999 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.615 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 3.5699999999999998 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.71 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.8099999999999996 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 3.21 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 3.21 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.552 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 5.3600000000000003 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.8199999999999998 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.472 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.7200000000000002 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.552 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.6400000000000001 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.8599999999999999 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.587 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.2799999999999998 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.6299999999999999 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 1.4399999999999999 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.76 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.8700000000000001 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.587 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 2.29 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 1.29 109.824 175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 3.3300000000000001 109.68 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 2.2000000000000002 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 2.4199999999999999 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 3.1600000000000001 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.9399999999999999 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.509 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.5699999999999998 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.6499999999999999 110.094 173.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 3.0099999999999998 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 2.2799999999999998 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.73 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 3.04 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 2.02 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.459 ' O ' HG21 ' A' ' 468' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 3.23 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.8100000000000001 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 2.0800000000000001 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 2.0800000000000001 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.459 HG21 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 2.2599999999999998 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.707 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 3.4100000000000001 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.46 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4900000000000002 109.985 173.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 6.0999999999999996 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.625 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.75 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.625 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.4700000000000002 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.882 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.6299999999999999 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 3.5699999999999998 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.882 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.71 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.8099999999999996 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 3.21 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 3.21 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 5.3600000000000003 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.8199999999999998 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.7200000000000002 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.456 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.6400000000000001 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.8599999999999999 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.2799999999999998 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.6299999999999999 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.432 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 1.4399999999999999 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.76 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.8700000000000001 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.448 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 2.29 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 1.29 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 3.3300000000000001 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.448 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 2.2000000000000002 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 2.4199999999999999 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 3.1600000000000001 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.9399999999999999 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.507 ' O ' HG21 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.5699999999999998 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 499' ' ' GLN . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.6499999999999999 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 3.0099999999999998 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.507 HG21 ' O ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 2.2799999999999998 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.73 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 3.04 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.585 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 2.02 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 3.23 110.642 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.8100000000000001 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 2.0800000000000001 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 2.0800000000000001 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.462 ' HB ' ' HA ' ' A' ' 478' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 2.2599999999999998 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.587 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 3.4100000000000001 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.46 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4900000000000002 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 6.0999999999999996 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.75 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.797 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.4700000000000002 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.741 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.6299999999999999 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 3.5699999999999998 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.741 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.71 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.8099999999999996 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 3.21 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 3.21 110.702 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 5.3600000000000003 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.8199999999999998 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.7200000000000002 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HA ' HG13 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.6400000000000001 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.8599999999999999 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.568 ' HB ' HD23 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.2799999999999998 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.6299999999999999 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.416 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 1.4399999999999999 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.76 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.8700000000000001 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.568 HD23 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 2.29 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 1.29 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 3.3300000000000001 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 2.2000000000000002 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 2.4199999999999999 109.021 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 3.1600000000000001 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.445 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.9399999999999999 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.5699999999999998 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.6499999999999999 110.226 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 3.0099999999999998 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 500' ' ' MET . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 2.2799999999999998 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.73 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 3.04 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 2.02 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 3.23 111.432 -175.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.619 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.8100000000000001 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 2.0800000000000001 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 2.0800000000000001 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 2.2599999999999998 110.321 -174.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.459 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 3.4100000000000001 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.46 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4900000000000002 110.207 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 6.0999999999999996 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.499 ' HG ' ' H ' ' A' ' 474' ' ' GLU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.75 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.4700000000000002 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.636 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.6299999999999999 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 3.5699999999999998 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.71 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.8099999999999996 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 3.21 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 3.21 110.624 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.459 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 5.3600000000000003 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.8199999999999998 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.7200000000000002 111.963 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.6400000000000001 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . 0.619 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.8599999999999999 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.2799999999999998 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.6299999999999999 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 1.4399999999999999 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.76 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.8700000000000001 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 2.29 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 1.29 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 3.3300000000000001 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 2.2000000000000002 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 2.4199999999999999 108.809 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 3.1600000000000001 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.9399999999999999 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.578 ' O ' HG21 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.5699999999999998 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.6499999999999999 109.899 173.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 3.0099999999999998 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.578 HG21 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 2.2799999999999998 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.73 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 3.04 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 2.02 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 3.23 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.501 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.8100000000000001 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 2.0800000000000001 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 2.0800000000000001 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.579 HG22 HD21 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 2.2599999999999998 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.613 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 3.4100000000000001 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.46 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4900000000000002 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 6.0999999999999996 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.481 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.75 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 477' ' ' ARG . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.4700000000000002 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.6299999999999999 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.503 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 3.5699999999999998 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.71 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.8099999999999996 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 3.21 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.579 HD21 HG22 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 3.21 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 5.3600000000000003 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.8199999999999998 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.7200000000000002 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.774 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.6400000000000001 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.8599999999999999 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.774 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.2799999999999998 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.6299999999999999 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 1.4399999999999999 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.438 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.76 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.8700000000000001 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 2.29 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 1.29 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.469 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 3.3300000000000001 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.469 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 2.2000000000000002 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.576 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 12.7 t-80 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 2.4199999999999999 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 3.1600000000000001 109.728 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.437 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.9399999999999999 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.606 ' HA ' ' CG2' ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.5699999999999998 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.6499999999999999 109.483 176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 3.0099999999999998 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.606 ' CG2' ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 2.2799999999999998 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.73 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 3.04 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.531 ' O ' HG13 ' A' ' 467' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 2.02 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.48 ' O ' HG12 ' A' ' 468' ' ' ILE . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 3.23 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.8100000000000001 110.185 178.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 2.0800000000000001 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 2.0800000000000001 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 2.2599999999999998 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.815 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 3.4100000000000001 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.46 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4900000000000002 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 6.0999999999999996 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.75 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.852 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.4700000000000002 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.6299999999999999 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.852 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 3.5699999999999998 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.815 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.71 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.8099999999999996 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 3.21 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 3.21 111.237 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 5.3600000000000003 109.007 173.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.8199999999999998 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.492 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.7200000000000002 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.6400000000000001 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.8599999999999999 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.552 HG23 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.2799999999999998 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.6299999999999999 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.447 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 1.4399999999999999 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.557 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.76 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.8700000000000001 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.552 ' HB2' HG23 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 491' ' ' ALA . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 2.29 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 1.29 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 3.3300000000000001 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.456 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 2.2000000000000002 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 2.4199999999999999 109.288 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 3.1600000000000001 109.904 178.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.9399999999999999 110.109 174.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.5699999999999998 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.6499999999999999 109.663 175.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 3.0099999999999998 111.214 173.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.557 HG21 ' O ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 2.2799999999999998 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 501' ' ' LEU . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.73 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 3.04 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 2.02 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.54 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 3.23 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.8100000000000001 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' SER . . . . . 0.469 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 2.0800000000000001 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 2.0800000000000001 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 2.2599999999999998 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 3.4100000000000001 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.46 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4900000000000002 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 6.0999999999999996 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.75 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.658 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.4700000000000002 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.6299999999999999 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 3.5699999999999998 112.029 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.71 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.8099999999999996 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 3.21 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 468' ' ' ILE . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 3.21 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.659 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 5.3600000000000003 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.8199999999999998 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 488' ' ' ILE . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.7200000000000002 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 482' ' ' MET . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.6400000000000001 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.8599999999999999 111.825 175.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . 0.494 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 484' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.2799999999999998 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.6299999999999999 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.624 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 1.4399999999999999 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.76 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.8700000000000001 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 2.29 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 1.29 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 3.3300000000000001 110.671 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 2.2000000000000002 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.418 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 2.4199999999999999 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 3.1600000000000001 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.9399999999999999 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.5699999999999998 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.6499999999999999 109.599 173.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 3.0099999999999998 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 2.2799999999999998 112.143 -178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.73 112.298 -172.014 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 3.04 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.478 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 2.02 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.576 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 3.23 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.502 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.8100000000000001 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 2.0800000000000001 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 2.0800000000000001 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 464' ' ' ILE . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 2.2599999999999998 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 3.4100000000000001 109.525 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.46 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4900000000000002 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 6.0999999999999996 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 474' ' ' GLU . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.75 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.673 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.4700000000000002 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.676 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.659 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.6299999999999999 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 3.5699999999999998 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.673 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.71 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.8099999999999996 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 3.21 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 3.21 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.502 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 5.3600000000000003 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.8199999999999998 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.7200000000000002 111.615 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.536 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.6400000000000001 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.8599999999999999 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.536 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.2799999999999998 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.6299999999999999 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 1.4399999999999999 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.76 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.8700000000000001 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.514 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 2.29 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.422 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 1.29 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.421 ' HD2' ' O ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 3.3300000000000001 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.514 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 2.2000000000000002 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 495' ' ' ALA . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 2.4199999999999999 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 3.1600000000000001 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.51 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.9399999999999999 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.424 ' O ' HG12 ' A' ' 505' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.5699999999999998 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.6499999999999999 111.033 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 3.0099999999999998 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 2.2799999999999998 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 501' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.73 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 3.04 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 2.02 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.425 ' CD1' ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 3.23 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.8100000000000001 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 2.0800000000000001 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 2.0800000000000001 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 2.2599999999999998 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 3.4100000000000001 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.46 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.457 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4900000000000002 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 6.0999999999999996 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.66 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.75 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.66 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.4700000000000002 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.775 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.767 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.6299999999999999 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.767 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 3.5699999999999998 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.775 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.71 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.8099999999999996 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 3.21 111.149 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.479 HD22 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 3.21 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 5.3600000000000003 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.8199999999999998 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.587 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.7200000000000002 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' A' ' 487' ' ' ASP . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.6400000000000001 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.8599999999999999 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . 0.509 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 484' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.2799999999999998 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.6299999999999999 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 1.4399999999999999 111.561 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.76 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.8700000000000001 111.549 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.428 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 2.29 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 1.29 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 3.3300000000000001 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 2.2000000000000002 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 2.4199999999999999 108.927 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.522 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 3.1600000000000001 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.538 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.9399999999999999 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.5699999999999998 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . 0.43 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.6499999999999999 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 3.0099999999999998 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 2.2799999999999998 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.73 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 3.04 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.423 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 2.02 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.459 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 3.23 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.8100000000000001 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 2.0800000000000001 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 2.0800000000000001 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.527 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 2.2599999999999998 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.719 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 3.4100000000000001 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.46 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.433 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4900000000000002 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 6.0999999999999996 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.403 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.75 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.682 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.4700000000000002 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.564 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.6299999999999999 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.682 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 3.5699999999999998 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.719 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.71 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.8099999999999996 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 3.21 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 3.21 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.527 ' HA ' HD11 ' A' ' 468' ' ' ILE . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 5.3600000000000003 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.8199999999999998 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.7200000000000002 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.6400000000000001 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . 0.514 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.8599999999999999 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 485' ' ' LEU . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.2799999999999998 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.52 ' HG2' HG21 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.6299999999999999 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.445 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 1.4399999999999999 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.76 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.8700000000000001 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.416 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.459 ' HB3' HG12 ' A' ' 464' ' ' ILE . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 2.29 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 1.29 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 3.3300000000000001 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.416 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 2.2000000000000002 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.422 ' HE2' HG23 ' A' ' 467' ' ' ILE . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 2.4199999999999999 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 3.1600000000000001 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.9399999999999999 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.422 ' O ' HG12 ' A' ' 505' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.5699999999999998 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.6499999999999999 109.942 174.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 3.0099999999999998 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 500' ' ' MET . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 2.2799999999999998 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.73 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 3.04 110.868 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.531 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 2.02 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 3.23 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.8100000000000001 110.361 173.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 2.0800000000000001 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 2.0800000000000001 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 2.2599999999999998 109.822 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 3.4100000000000001 111.567 178.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.46 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.403 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4900000000000002 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 6.0999999999999996 111.925 -173.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.517 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.75 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.878 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.4700000000000002 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.809 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.6299999999999999 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.878 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 3.5699999999999998 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.809 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.71 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.8099999999999996 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 3.21 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 3.21 111.734 -174.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 5.3600000000000003 109.15 175.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.8199999999999998 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.7200000000000002 111.347 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.679 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.6400000000000001 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.8599999999999999 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.679 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.2799999999999998 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.6299999999999999 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 1.4399999999999999 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.76 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.8700000000000001 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 2.29 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.457 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 1.29 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 3.3300000000000001 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 2.2000000000000002 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 2.4199999999999999 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 3.1600000000000001 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.53 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.9399999999999999 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.5699999999999998 111.91 -172.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.6499999999999999 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 3.0099999999999998 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 500' ' ' MET . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 2.2799999999999998 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.73 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 3.04 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 2.02 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 3.23 110.384 -175.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.462 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.8100000000000001 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 2.0800000000000001 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 498' ' ' HIS . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 2.0800000000000001 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.921 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 2.2599999999999998 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 465' ' ' ARG . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 3.4100000000000001 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.46 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4900000000000002 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 6.0999999999999996 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.748 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.75 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.748 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.4700000000000002 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 1.064 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . 0.467 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.6299999999999999 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 3.5699999999999998 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 1.064 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.71 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.8099999999999996 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 3.21 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 3.21 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.457 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 5.3600000000000003 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.8199999999999998 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.7200000000000002 111.107 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.855 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.6400000000000001 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.8599999999999999 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.855 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.2799999999999998 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.6299999999999999 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 1.4399999999999999 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.76 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.8700000000000001 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.64 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 2.29 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 1.29 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 3.3300000000000001 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 2.2000000000000002 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 467' ' ' ILE . 31.8 t-80 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 2.4199999999999999 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 3.1600000000000001 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.451 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.9399999999999999 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.5699999999999998 110.998 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . 0.443 ' CG1' ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.6499999999999999 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 3.0099999999999998 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 2.2799999999999998 109.672 171.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.73 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 3.04 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 2.02 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 3.23 111.247 -175.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.8100000000000001 110.28 -177.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 2.0800000000000001 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 463' ' ' VAL . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 2.0800000000000001 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 478' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 2.2599999999999998 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.533 ' HE3' ' SD ' ' A' ' 482' ' ' MET . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 3.4100000000000001 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.46 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.459 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4900000000000002 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 6.0999999999999996 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.984 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.75 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.984 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.4700000000000002 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.6299999999999999 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 3.5699999999999998 110.952 174.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.558 ' HB2' HD13 ' A' ' 468' ' ' ILE . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.71 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.8099999999999996 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 3.21 110.786 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 3.21 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.533 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 5.3600000000000003 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.8199999999999998 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.521 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.7200000000000002 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.574 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.6400000000000001 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.8599999999999999 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . 0.526 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.2799999999999998 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.6299999999999999 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 1.4399999999999999 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.76 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.8700000000000001 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . 0.46 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 2.29 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 1.29 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 3.3300000000000001 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 2.2000000000000002 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 2.4199999999999999 108.125 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 3.1600000000000001 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.556 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.9399999999999999 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.5699999999999998 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.6499999999999999 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 3.0099999999999998 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 2.2799999999999998 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.73 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 3.04 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 2.02 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.507 HD11 HD21 ' A' ' 485' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 3.23 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.938 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.8100000000000001 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 2.0800000000000001 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 2.0800000000000001 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . 0.539 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 2.2599999999999998 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 466' ' ' SER . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 3.4100000000000001 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.46 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.46 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4900000000000002 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . 0.412 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 6.0999999999999996 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 471' ' ' SER . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.75 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.4700000000000002 112.262 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.416 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.6299999999999999 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.404 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 3.5699999999999998 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.539 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.71 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.8099999999999996 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 3.21 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 3.21 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.938 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 5.3600000000000003 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.8199999999999998 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.7200000000000002 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.769 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.6400000000000001 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.8599999999999999 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.769 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.2799999999999998 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.6299999999999999 110.534 -176.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 1.4399999999999999 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.76 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.8700000000000001 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 2.29 110.227 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 1.29 109.421 173.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 3.3300000000000001 109.919 175.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 2.2000000000000002 109.693 177.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 2.4199999999999999 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 3.1600000000000001 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.672 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.9399999999999999 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.5699999999999998 112.258 -175.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.6499999999999999 110.516 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.672 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 3.0099999999999998 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.534 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 2.2799999999999998 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.73 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 3.04 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' VAL . . . . . 0.56 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 2.02 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . 0.461 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 3.23 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.8100000000000001 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 2.0800000000000001 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 2.0800000000000001 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 2.2599999999999998 110.656 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 3.4100000000000001 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.46 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' SER . . . . . 0.415 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4900000000000002 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 6.0999999999999996 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.679 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.75 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.707 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.4700000000000002 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.687 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.6299999999999999 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' ARG . . . . . 0.707 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 3.5699999999999998 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.71 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.8099999999999996 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' TYR . . . . . 0.476 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 3.21 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 3.21 110.991 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' MET . . . . . 0.431 ' HA ' ' CD2' ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 5.3600000000000003 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.8199999999999998 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.7200000000000002 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . 0.431 ' CD2' ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.6400000000000001 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.8599999999999999 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.2799999999999998 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.6299999999999999 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . 0.44 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 1.4399999999999999 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.76 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.8700000000000001 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 2.29 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.586 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 1.29 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 3.3300000000000001 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 2.2000000000000002 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' HIS . . . . . 0.586 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 2.4199999999999999 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . 0.642 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 3.1600000000000001 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' MET . . . . . 0.525 ' O ' HG13 ' A' ' 504' ' ' ILE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.9399999999999999 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.5699999999999998 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.6499999999999999 110.484 176.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . 0.642 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 3.0099999999999998 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 2.2799999999999998 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.73 111.016 -178.226 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 3.04 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 2.02 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.786 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 3.23 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.633 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.8100000000000001 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 2.0800000000000001 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 463' ' ' VAL . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 2.0800000000000001 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 2.2599999999999998 110.499 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.658 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 3.4100000000000001 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.46 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4900000000000002 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 6.0999999999999996 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.496 ' HG ' ' H ' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.75 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.561 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.4700000000000002 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.507 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.6299999999999999 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 3.5699999999999998 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.71 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.8099999999999996 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . 0.488 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 3.21 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 3.21 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.633 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 5.3600000000000003 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.8199999999999998 110.609 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.7200000000000002 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.535 ' HA ' HG12 ' A' ' 488' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.6400000000000001 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.8599999999999999 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 485' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.2799999999999998 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.6299999999999999 111.319 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 1.4399999999999999 111.26 177.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.76 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.8700000000000001 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.786 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 2.29 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 1.29 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 3.3300000000000001 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 2.2000000000000002 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 2.4199999999999999 109.024 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 3.1600000000000001 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.546 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.9399999999999999 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.5699999999999998 112.52 -173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.6499999999999999 110.248 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 3.0099999999999998 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 2.2799999999999998 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.48 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.73 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 3.04 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 2.02 110.891 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 3.23 110.869 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.8100000000000001 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 2.0800000000000001 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 2.0800000000000001 111.163 177.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.859 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 2.2599999999999998 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 3.4100000000000001 110.825 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.46 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4900000000000002 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 6.0999999999999996 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.75 107.945 170.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.4700000000000002 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.44 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.6299999999999999 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.455 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 3.5699999999999998 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.859 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.71 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.8099999999999996 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . 0.455 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 3.21 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 3.21 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 5.3600000000000003 110.505 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.8199999999999998 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.475 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.7200000000000002 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.624 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.6400000000000001 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.8599999999999999 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.624 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.2799999999999998 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.6299999999999999 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.494 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 1.4399999999999999 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.76 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.8700000000000001 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 2.29 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 1.29 110.053 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 3.3300000000000001 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 2.2000000000000002 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 2.4199999999999999 109.1 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 503' ' ' LYS . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 3.1600000000000001 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.411 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.9399999999999999 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.56 ' O ' HG21 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.5699999999999998 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.6499999999999999 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 3.0099999999999998 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.56 HG21 ' O ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 2.2799999999999998 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.73 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 3.04 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.631 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 2.02 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.616 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 3.23 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.406 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.8100000000000001 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 2.0800000000000001 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.631 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 2.0800000000000001 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.539 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 2.2599999999999998 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.449 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 3.4100000000000001 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.46 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4900000000000002 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . 0.652 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 6.0999999999999996 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.765 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.75 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.765 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.4700000000000002 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.672 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.6299999999999999 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.627 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 3.5699999999999998 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.672 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.71 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.8099999999999996 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . 0.627 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 3.21 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 3.21 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 5.3600000000000003 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.8199999999999998 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.718 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.6400000000000001 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . 0.406 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.8599999999999999 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.718 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.2799999999999998 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.6299999999999999 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.573 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 1.4399999999999999 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.76 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.8700000000000001 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 2.29 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 1.29 109.823 179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 3.3300000000000001 110.257 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 2.2000000000000002 110.193 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.616 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 2.4199999999999999 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 3.1600000000000001 109.566 172.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.9399999999999999 110.445 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.599 ' O ' HG21 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.5699999999999998 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.6499999999999999 109.661 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 3.0099999999999998 111.151 175.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.599 HG21 ' O ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 2.2799999999999998 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 501' ' ' LEU . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.73 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 3.04 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 2.02 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.521 ' O ' HG13 ' A' ' 468' ' ' ILE . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 3.23 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.8100000000000001 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 2.0800000000000001 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 2.0800000000000001 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.799 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 2.2599999999999998 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 3.4100000000000001 110.536 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.46 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.501 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4900000000000002 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 6.0999999999999996 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.75 111.198 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.4700000000000002 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.469 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.6299999999999999 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.541 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 3.5699999999999998 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.799 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.71 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . 0.469 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.8099999999999996 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 3.21 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.504 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 3.21 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.593 ' HB3' HD13 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 5.3600000000000003 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.8199999999999998 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.7200000000000002 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.668 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.6400000000000001 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.8599999999999999 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.668 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.2799999999999998 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.485 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.6299999999999999 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.425 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 1.4399999999999999 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.76 113.853 -166.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.8700000000000001 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 2.29 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.29 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 3.3300000000000001 110.298 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 2.2000000000000002 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 2.4199999999999999 109.013 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 3.1600000000000001 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.61 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.9399999999999999 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.5699999999999998 111.486 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.6499999999999999 110.633 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 3.0099999999999998 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 500' ' ' MET . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 2.2799999999999998 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.73 112.777 -177.358 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 3.04 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 2.02 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 3.23 110.861 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.8100000000000001 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 2.0800000000000001 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 2.0800000000000001 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 2.2599999999999998 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 3.4100000000000001 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.46 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4900000000000002 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 6.0999999999999996 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.531 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.75 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.561 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.4700000000000002 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.6299999999999999 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 3.5699999999999998 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.71 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.8099999999999996 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 3.21 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 3.21 111.816 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.489 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 5.3600000000000003 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.8199999999999998 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.7200000000000002 110.582 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.489 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.6400000000000001 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.8599999999999999 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.46 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.2799999999999998 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.6299999999999999 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 1.4399999999999999 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.76 110.447 176.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.8700000000000001 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 2.29 111.598 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 1.29 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 3.3300000000000001 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.4 ' O ' ' HB3' ' A' ' 500' ' ' MET . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 2.2000000000000002 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 2.4199999999999999 109.752 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 3.1600000000000001 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.52 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.9399999999999999 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.5699999999999998 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.6499999999999999 110.262 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 3.0099999999999998 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 2.2799999999999998 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.73 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 3.04 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 2.02 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.413 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 3.23 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.8100000000000001 110.74 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 2.0800000000000001 110.756 -177.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 2.0800000000000001 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 2.2599999999999998 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.688 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 3.4100000000000001 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.46 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4900000000000002 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 6.0999999999999996 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.693 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.75 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.693 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.4700000000000002 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.6299999999999999 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.615 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 3.5699999999999998 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.71 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.8099999999999996 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 3.21 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 3.21 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.552 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 5.3600000000000003 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.8199999999999998 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.472 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.7200000000000002 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.552 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.6400000000000001 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.8599999999999999 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.587 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.2799999999999998 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.6299999999999999 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 1.4399999999999999 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.76 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.8700000000000001 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.587 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 2.29 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 1.29 109.824 175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 3.3300000000000001 109.68 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 2.2000000000000002 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 2.4199999999999999 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 3.1600000000000001 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.9399999999999999 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.509 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.5699999999999998 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.6499999999999999 110.094 173.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 3.0099999999999998 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 2.2799999999999998 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.73 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 3.04 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 2.02 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.459 ' O ' HG21 ' A' ' 468' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 3.23 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.8100000000000001 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 2.0800000000000001 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 2.0800000000000001 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.459 HG21 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 2.2599999999999998 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.707 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 3.4100000000000001 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.46 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4900000000000002 109.985 173.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 6.0999999999999996 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.625 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.75 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.625 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.4700000000000002 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.882 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.6299999999999999 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 3.5699999999999998 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.882 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.71 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.8099999999999996 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 3.21 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 3.21 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 5.3600000000000003 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.8199999999999998 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.7200000000000002 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.456 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.6400000000000001 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.8599999999999999 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.2799999999999998 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.6299999999999999 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.432 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 1.4399999999999999 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.76 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.8700000000000001 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.448 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 2.29 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 1.29 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 3.3300000000000001 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.448 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 2.2000000000000002 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 2.4199999999999999 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 3.1600000000000001 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.9399999999999999 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.507 ' O ' HG21 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.5699999999999998 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 499' ' ' GLN . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.6499999999999999 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 3.0099999999999998 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.507 HG21 ' O ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 2.2799999999999998 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.73 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 3.04 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.585 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 2.02 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 3.23 110.642 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.8100000000000001 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 2.0800000000000001 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 2.0800000000000001 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.462 ' HB ' ' HA ' ' A' ' 478' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 2.2599999999999998 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.587 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 3.4100000000000001 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.46 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4900000000000002 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 6.0999999999999996 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.75 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.797 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.4700000000000002 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.741 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.6299999999999999 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 3.5699999999999998 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.741 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.71 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.8099999999999996 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 3.21 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 3.21 110.702 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 5.3600000000000003 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.8199999999999998 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.7200000000000002 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HA ' HG13 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.6400000000000001 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.8599999999999999 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.568 ' HB ' HD23 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.2799999999999998 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.6299999999999999 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.416 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 1.4399999999999999 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.76 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.8700000000000001 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.568 HD23 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 2.29 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 1.29 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 3.3300000000000001 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 2.2000000000000002 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 2.4199999999999999 109.021 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 3.1600000000000001 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.445 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.9399999999999999 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.5699999999999998 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.6499999999999999 110.226 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 3.0099999999999998 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 500' ' ' MET . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 2.2799999999999998 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.73 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 3.04 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 2.02 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 3.23 111.432 -175.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.619 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.8100000000000001 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 2.0800000000000001 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 2.0800000000000001 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 2.2599999999999998 110.321 -174.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.459 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 3.4100000000000001 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.46 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4900000000000002 110.207 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 6.0999999999999996 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.499 ' HG ' ' H ' ' A' ' 474' ' ' GLU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.75 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.4700000000000002 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.636 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.6299999999999999 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 3.5699999999999998 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.71 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.8099999999999996 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 3.21 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 3.21 110.624 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.459 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 5.3600000000000003 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.8199999999999998 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.7200000000000002 111.963 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.6400000000000001 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . 0.619 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.8599999999999999 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.2799999999999998 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.6299999999999999 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 1.4399999999999999 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.76 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.8700000000000001 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 2.29 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 1.29 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 3.3300000000000001 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 2.2000000000000002 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 2.4199999999999999 108.809 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 3.1600000000000001 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.9399999999999999 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.578 ' O ' HG21 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.5699999999999998 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.6499999999999999 109.899 173.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 3.0099999999999998 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.578 HG21 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 2.2799999999999998 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.73 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 3.04 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 2.02 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 3.23 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.501 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.8100000000000001 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 2.0800000000000001 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 2.0800000000000001 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.579 HG22 HD21 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 2.2599999999999998 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.613 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 3.4100000000000001 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.46 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4900000000000002 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 6.0999999999999996 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.481 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.75 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 477' ' ' ARG . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.4700000000000002 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.6299999999999999 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.503 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 3.5699999999999998 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.71 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.8099999999999996 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 3.21 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.579 HD21 HG22 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 3.21 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 5.3600000000000003 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.8199999999999998 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.7200000000000002 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.774 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.6400000000000001 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.8599999999999999 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.774 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.2799999999999998 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.6299999999999999 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 1.4399999999999999 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.438 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.76 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.8700000000000001 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 2.29 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 1.29 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.469 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 3.3300000000000001 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.469 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 2.2000000000000002 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.576 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 12.7 t-80 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 2.4199999999999999 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 3.1600000000000001 109.728 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.437 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.9399999999999999 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.606 ' HA ' ' CG2' ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.5699999999999998 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.6499999999999999 109.483 176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 3.0099999999999998 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.606 ' CG2' ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 2.2799999999999998 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.73 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 3.04 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.531 ' O ' HG13 ' A' ' 467' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 2.02 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.48 ' O ' HG12 ' A' ' 468' ' ' ILE . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 3.23 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.8100000000000001 110.185 178.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 2.0800000000000001 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 2.0800000000000001 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 2.2599999999999998 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.815 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 3.4100000000000001 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.46 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4900000000000002 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 6.0999999999999996 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.75 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.852 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.4700000000000002 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.6299999999999999 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.852 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 3.5699999999999998 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.815 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.71 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.8099999999999996 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 3.21 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 3.21 111.237 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 5.3600000000000003 109.007 173.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.8199999999999998 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.492 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.7200000000000002 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.6400000000000001 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.8599999999999999 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.552 HG23 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.2799999999999998 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.6299999999999999 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.447 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 1.4399999999999999 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.557 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.76 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.8700000000000001 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.552 ' HB2' HG23 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 491' ' ' ALA . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 2.29 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 1.29 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 3.3300000000000001 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.456 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 2.2000000000000002 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 2.4199999999999999 109.288 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 3.1600000000000001 109.904 178.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.9399999999999999 110.109 174.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.5699999999999998 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.6499999999999999 109.663 175.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 3.0099999999999998 111.214 173.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.557 HG21 ' O ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 2.2799999999999998 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 501' ' ' LEU . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.73 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 3.04 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 2.02 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.54 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 3.23 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.8100000000000001 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' SER . . . . . 0.469 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 2.0800000000000001 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 2.0800000000000001 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 2.2599999999999998 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 3.4100000000000001 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.46 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4900000000000002 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 6.0999999999999996 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.75 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.658 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.4700000000000002 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.6299999999999999 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 3.5699999999999998 112.029 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.71 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.8099999999999996 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 3.21 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 468' ' ' ILE . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 3.21 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.659 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 5.3600000000000003 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.8199999999999998 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 488' ' ' ILE . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.7200000000000002 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 482' ' ' MET . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.6400000000000001 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.8599999999999999 111.825 175.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . 0.494 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 484' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.2799999999999998 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.6299999999999999 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.624 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 1.4399999999999999 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.76 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.8700000000000001 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 2.29 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 1.29 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 3.3300000000000001 110.671 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 2.2000000000000002 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.418 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 2.4199999999999999 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 3.1600000000000001 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.9399999999999999 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.5699999999999998 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.6499999999999999 109.599 173.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 3.0099999999999998 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 2.2799999999999998 112.143 -178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.73 112.298 -172.014 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 3.04 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.478 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 2.02 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.576 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 3.23 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.502 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.8100000000000001 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 2.0800000000000001 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 2.0800000000000001 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 464' ' ' ILE . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 2.2599999999999998 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 3.4100000000000001 109.525 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.46 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4900000000000002 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 6.0999999999999996 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 474' ' ' GLU . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.75 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.673 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.4700000000000002 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.676 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.659 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.6299999999999999 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 3.5699999999999998 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.673 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.71 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.8099999999999996 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 3.21 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 3.21 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.502 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 5.3600000000000003 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.8199999999999998 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.7200000000000002 111.615 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.536 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.6400000000000001 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.8599999999999999 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.536 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.2799999999999998 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.6299999999999999 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 1.4399999999999999 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.76 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.8700000000000001 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.514 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 2.29 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.422 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 1.29 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.421 ' HD2' ' O ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 3.3300000000000001 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.514 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 2.2000000000000002 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 495' ' ' ALA . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 2.4199999999999999 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 3.1600000000000001 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.51 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.9399999999999999 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.424 ' O ' HG12 ' A' ' 505' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.5699999999999998 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.6499999999999999 111.033 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 3.0099999999999998 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 2.2799999999999998 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 501' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.73 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 3.04 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 2.02 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.425 ' CD1' ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 3.23 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.8100000000000001 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 2.0800000000000001 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 2.0800000000000001 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 2.2599999999999998 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 3.4100000000000001 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.46 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.457 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4900000000000002 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 6.0999999999999996 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.66 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.75 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.66 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.4700000000000002 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.775 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.767 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.6299999999999999 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.767 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 3.5699999999999998 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.775 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.71 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.8099999999999996 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 3.21 111.149 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.479 HD22 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 3.21 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 5.3600000000000003 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.8199999999999998 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.587 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.7200000000000002 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' A' ' 487' ' ' ASP . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.6400000000000001 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.8599999999999999 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . 0.509 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 484' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.2799999999999998 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.6299999999999999 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 1.4399999999999999 111.561 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.76 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.8700000000000001 111.549 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.428 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 2.29 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 1.29 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 3.3300000000000001 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 2.2000000000000002 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 2.4199999999999999 108.927 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.522 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 3.1600000000000001 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.538 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.9399999999999999 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.5699999999999998 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . 0.43 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.6499999999999999 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 3.0099999999999998 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 2.2799999999999998 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.73 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 3.04 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.423 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 2.02 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.459 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 3.23 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.8100000000000001 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 2.0800000000000001 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 2.0800000000000001 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.527 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 2.2599999999999998 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.719 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 3.4100000000000001 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.46 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.433 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4900000000000002 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 6.0999999999999996 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.403 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.75 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.682 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.4700000000000002 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.564 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.6299999999999999 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.682 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 3.5699999999999998 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.719 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.71 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.8099999999999996 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 3.21 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 3.21 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.527 ' HA ' HD11 ' A' ' 468' ' ' ILE . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 5.3600000000000003 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.8199999999999998 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.7200000000000002 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.6400000000000001 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . 0.514 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.8599999999999999 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 485' ' ' LEU . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.2799999999999998 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.52 ' HG2' HG21 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.6299999999999999 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.445 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 1.4399999999999999 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.76 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.8700000000000001 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.416 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.459 ' HB3' HG12 ' A' ' 464' ' ' ILE . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 2.29 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 1.29 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 3.3300000000000001 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.416 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 2.2000000000000002 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.422 ' HE2' HG23 ' A' ' 467' ' ' ILE . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 2.4199999999999999 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 3.1600000000000001 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.9399999999999999 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.422 ' O ' HG12 ' A' ' 505' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.5699999999999998 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.6499999999999999 109.942 174.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 3.0099999999999998 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 500' ' ' MET . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 2.2799999999999998 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.73 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 3.04 110.868 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.531 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 2.02 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 3.23 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.8100000000000001 110.361 173.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 2.0800000000000001 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 2.0800000000000001 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 2.2599999999999998 109.822 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 3.4100000000000001 111.567 178.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.46 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.403 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4900000000000002 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 6.0999999999999996 111.925 -173.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.517 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.75 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.878 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.4700000000000002 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.809 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.6299999999999999 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.878 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 3.5699999999999998 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.809 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.71 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.8099999999999996 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 3.21 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 3.21 111.734 -174.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 5.3600000000000003 109.15 175.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.8199999999999998 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.7200000000000002 111.347 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.679 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.6400000000000001 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.8599999999999999 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.679 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.2799999999999998 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.6299999999999999 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 1.4399999999999999 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.76 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.8700000000000001 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 2.29 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.457 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 1.29 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 3.3300000000000001 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.52 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 2.2000000000000002 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 2.4199999999999999 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 3.1600000000000001 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.53 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.9399999999999999 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.5699999999999998 111.91 -172.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.6499999999999999 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 3.0099999999999998 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 500' ' ' MET . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 2.2799999999999998 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.73 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 3.04 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 2.02 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 3.23 110.384 -175.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.462 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.8100000000000001 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 2.0800000000000001 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 498' ' ' HIS . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 2.0800000000000001 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.921 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 2.2599999999999998 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 465' ' ' ARG . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 3.4100000000000001 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.46 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4900000000000002 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 6.0999999999999996 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.748 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.75 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.748 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.4700000000000002 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 1.064 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . 0.467 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.6299999999999999 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 3.5699999999999998 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 1.064 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.71 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.8099999999999996 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 3.21 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 3.21 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.457 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 5.3600000000000003 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.8199999999999998 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.7200000000000002 111.107 176.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.855 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.6400000000000001 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.8599999999999999 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.855 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.2799999999999998 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.6299999999999999 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 1.4399999999999999 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.76 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.8700000000000001 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.64 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 2.29 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 1.29 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 3.3300000000000001 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 2.2000000000000002 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 467' ' ' ILE . 31.8 t-80 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 2.4199999999999999 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 3.1600000000000001 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.451 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.9399999999999999 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.5699999999999998 110.998 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . 0.443 ' CG1' ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.6499999999999999 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 3.0099999999999998 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 2.2799999999999998 109.672 171.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.73 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 3.04 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 2.02 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 3.23 111.247 -175.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.8100000000000001 110.28 -177.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 2.0800000000000001 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 463' ' ' VAL . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 2.0800000000000001 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 478' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 2.2599999999999998 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.533 ' HE3' ' SD ' ' A' ' 482' ' ' MET . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 3.4100000000000001 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.46 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.459 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4900000000000002 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 6.0999999999999996 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.984 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.75 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.984 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.4700000000000002 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.6299999999999999 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 3.5699999999999998 110.952 174.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.558 ' HB2' HD13 ' A' ' 468' ' ' ILE . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.71 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.8099999999999996 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 3.21 110.786 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 3.21 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.533 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 5.3600000000000003 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.8199999999999998 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.521 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.7200000000000002 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.574 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.6400000000000001 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.8599999999999999 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . 0.526 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.2799999999999998 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.6299999999999999 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 1.4399999999999999 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.76 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.8700000000000001 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . 0.46 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 2.29 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 1.29 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 3.3300000000000001 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 2.2000000000000002 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 2.4199999999999999 108.125 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 3.1600000000000001 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.556 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.9399999999999999 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.5699999999999998 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.6499999999999999 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 3.0099999999999998 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 2.2799999999999998 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.73 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 3.04 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 2.02 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.507 HD11 HD21 ' A' ' 485' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 3.23 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.938 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.8100000000000001 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 2.0800000000000001 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 2.0800000000000001 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . 0.539 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 2.2599999999999998 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 466' ' ' SER . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 3.4100000000000001 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.46 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.46 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4900000000000002 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . 0.412 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 6.0999999999999996 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 471' ' ' SER . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.75 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.4700000000000002 112.262 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.416 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.6299999999999999 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.404 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 3.5699999999999998 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.539 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.71 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.8099999999999996 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 3.21 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 3.21 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.938 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 5.3600000000000003 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.8199999999999998 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.7200000000000002 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.769 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.6400000000000001 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.8599999999999999 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.769 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.2799999999999998 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.6299999999999999 110.534 -176.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 1.4399999999999999 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.76 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.8700000000000001 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 2.29 110.227 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 1.29 109.421 173.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 3.3300000000000001 109.919 175.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 2.2000000000000002 109.693 177.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 2.4199999999999999 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 3.1600000000000001 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.672 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.9399999999999999 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.5699999999999998 112.258 -175.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.6499999999999999 110.516 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.672 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 3.0099999999999998 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.534 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 2.2799999999999998 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.73 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 3.04 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' VAL . . . . . 0.56 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 2.02 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . 0.461 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 3.23 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.8100000000000001 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 2.0800000000000001 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 2.0800000000000001 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 2.2599999999999998 110.656 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 3.4100000000000001 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.46 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' SER . . . . . 0.415 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4900000000000002 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 6.0999999999999996 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.679 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.75 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.707 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.4700000000000002 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.687 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.6299999999999999 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' ARG . . . . . 0.707 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 3.5699999999999998 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.71 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.8099999999999996 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' TYR . . . . . 0.476 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 3.21 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 3.21 110.991 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' MET . . . . . 0.431 ' HA ' ' CD2' ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 5.3600000000000003 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.8199999999999998 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.7200000000000002 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . 0.431 ' CD2' ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.6400000000000001 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.8599999999999999 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.2799999999999998 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.6299999999999999 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . 0.44 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 1.4399999999999999 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.76 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.8700000000000001 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 2.29 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.586 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 1.29 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 3.3300000000000001 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 2.2000000000000002 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' HIS . . . . . 0.586 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 2.4199999999999999 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . 0.642 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 3.1600000000000001 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' MET . . . . . 0.525 ' O ' HG13 ' A' ' 504' ' ' ILE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.9399999999999999 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.5699999999999998 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.6499999999999999 110.484 176.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . 0.642 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 3.0099999999999998 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 2.2799999999999998 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.73 111.016 -178.226 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 2.7 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.518 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 1.5 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.886 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 2.72 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.703 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.37 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 1.63 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.697 HG21 ' CE1' ' A' ' 498' ' ' HIS . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 1.59 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.649 HD13 HD12 ' A' ' 485' ' ' LEU . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 1.65 110.499 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.702 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 2.97 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.1 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.562 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 5.5 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.652 HD12 ' HG2' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.32 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.652 ' HG2' HD12 ' A' ' 473' ' ' LEU . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.47 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.551 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.63 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.604 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 2.98 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.3 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.14 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.514 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 2.93 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 2.73 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.703 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 4.93 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.495 HG22 ' O ' ' A' ' 480' ' ' TYR . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.46 110.609 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.28 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 468' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.19 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.86 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.66 ' HB ' HD21 ' A' ' 494' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.27 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 489' ' ' LYS . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.28 111.319 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.404 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 0.96 111.26 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.22 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.38 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.886 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 1.77 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 0.68 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 2.98 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 1.82 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.79 ' HB2' HD12 ' A' ' 464' ' ' ILE . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 1.85 109.024 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 2.63 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.571 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.52 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' A' ' 504' ' ' ILE . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.09 112.52 -173.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.476 ' N ' HD12 ' A' ' 501' ' ' LEU . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.11 110.248 -178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 2.54 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 1.75 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.488 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.19 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 2.7 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 467' ' ' ILE . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 1.5 110.891 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.916 HD13 ' HA ' ' A' ' 498' ' ' HIS . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 2.72 110.869 -178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.37 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 1.63 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.457 ' HB ' HD12 ' A' ' 464' ' ' ILE . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 1.59 111.163 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 1.008 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 1.65 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.601 ' N ' HD12 ' A' ' 468' ' ' ILE . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 2.97 110.825 176.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.1 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 5.5 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 478' ' ' LYS . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.32 107.945 170.758 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.47 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.63 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.493 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 1.008 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.3 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.14 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 2.93 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 2.73 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 485' ' ' LEU . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 4.93 110.505 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.46 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.494 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.28 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.19 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.86 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.819 HG22 ' H ' ' A' ' 490' ' ' GLY . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.27 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.28 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.819 ' H ' HG22 ' A' ' 488' ' ' ILE . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 0.96 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.22 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.38 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 1.77 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.467 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 0.68 110.053 176.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 2.98 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 1.82 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.916 ' HA ' HD13 ' A' ' 464' ' ' ILE . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 1.85 109.1 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.651 ' HA ' HG12 ' A' ' 502' ' ' VAL . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 2.63 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.444 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.52 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.757 ' HA ' HG22 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.09 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.651 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.11 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 2.54 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 1.75 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.19 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 2.7 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 1.5 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.664 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 2.72 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.448 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.37 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 1.63 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 1.59 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.569 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 1.65 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.521 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 2.97 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.1 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ARG . . . . . 0.735 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 5.5 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.816 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.32 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.816 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.47 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.702 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.63 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.681 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 2.98 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.3 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.14 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 2.93 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 2.73 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 4.93 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.46 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.28 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.844 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.19 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ASP . . . . . 0.448 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.86 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.844 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.27 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.28 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.596 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 0.96 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.474 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.22 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.38 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.729 HD12 ' N ' ' A' ' 495' ' ' ALA . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 1.77 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.729 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.68 109.823 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 2.98 110.257 177.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 500' ' ' MET . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 1.82 110.193 174.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.664 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 1.85 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 2.63 109.566 172.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.52 110.445 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.737 ' HA ' HG22 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.09 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 498' ' ' HIS . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.11 109.661 173.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 2.54 111.151 175.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.737 HG22 ' HA ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 1.75 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.693 HG23 HG23 ' A' ' 504' ' ' ILE . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.19 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 2.7 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 1.5 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.608 HD11 ' HB2' ' A' ' 498' ' ' HIS . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 2.72 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.37 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 1.63 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 1.59 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.919 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 1.65 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.687 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 2.97 110.536 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.1 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.53 HD13 HD13 ' A' ' 505' ' ' ILE . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.32 111.198 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.47 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.514 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.63 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 2.98 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.919 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.3 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 479' ' ' ARG . . . . . 0.514 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.14 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 2.93 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.703 HD13 HG21 ' A' ' 468' ' ' ILE . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 2.73 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.639 ' HB3' HD11 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 4.93 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.46 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.28 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.721 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.19 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.86 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.721 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.27 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.28 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.45 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 0.96 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.22 113.853 -166.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.38 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.583 HD23 HD11 ' A' ' 485' ' ' LEU . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 1.77 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 0.68 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 500' ' ' MET . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 2.98 110.298 178.442 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 1.82 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.608 ' HB2' HD11 ' A' ' 464' ' ' ILE . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 1.85 109.013 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 2.63 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.646 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.52 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 502' ' ' VAL . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.09 111.486 -176.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.414 ' N ' HD12 ' A' ' 501' ' ' LEU . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.11 110.633 176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.831 HG22 HG23 ' A' ' 505' ' ' ILE . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 1.75 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.831 HG23 HG22 ' A' ' 504' ' ' ILE . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.19 112.777 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 2.7 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 1.5 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 485' ' ' LEU . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 2.72 110.861 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.37 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 1.63 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 1.59 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 1.65 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 2.97 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.1 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 5.5 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.32 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.608 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.47 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.45 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.63 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.608 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 2.98 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.3 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 479' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.14 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 2.93 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 497' ' ' PHE . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 2.73 111.816 -176.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.54 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 4.93 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.46 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 488' ' ' ILE . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.28 110.582 173.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.19 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.86 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.27 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.28 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 0.96 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.42 ' HA ' HD21 ' A' ' 494' ' ' LEU . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.22 110.447 176.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.38 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 488' ' ' ILE . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 1.77 111.598 -175.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 0.68 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 2.98 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HB3' HD11 ' A' ' 481' ' ' LEU . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 1.82 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 502' ' ' VAL . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 1.85 109.752 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 2.63 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.545 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.52 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.09 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 498' ' ' HIS . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.11 110.262 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 2.54 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 1.75 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.19 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 2.7 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 1.5 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.661 HG23 HD11 ' A' ' 485' ' ' LEU . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 2.72 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 465' ' ' ARG . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.37 110.74 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 1.63 110.756 -177.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 1.59 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 1.65 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 2.97 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.1 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 5.5 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.32 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.771 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.47 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 478' ' ' LYS . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.63 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 2.98 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.3 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.14 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 2.93 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 2.73 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.602 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 4.93 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.46 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.28 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.661 HD11 HG23 ' A' ' 464' ' ' ILE . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.19 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.86 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.827 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.27 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.28 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 0.96 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.22 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.38 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.827 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 1.77 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.446 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 0.68 109.824 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 2.98 109.68 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 1.82 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.527 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 1.85 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 2.63 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.52 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.09 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 498' ' ' HIS . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.11 110.094 173.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 2.54 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 1.75 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.19 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 2.7 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 1.5 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.61 ' H ' HD12 ' A' ' 464' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 2.72 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.37 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 1.63 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 1.59 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.517 HG23 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 1.65 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.759 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 2.97 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.1 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB2' HD21 ' A' ' 473' ' ' LEU . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4 109.985 173.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 5.5 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.676 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.32 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.676 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.47 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.978 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.63 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.484 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 2.98 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.978 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.3 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.14 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 2.93 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 2.73 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 4.93 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.46 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.54 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.28 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.501 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.19 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.86 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.27 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.28 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 0.96 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.22 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.38 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.472 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 1.77 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.68 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 2.98 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 1.82 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.533 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 1.85 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 2.63 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.52 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HA ' HG22 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.09 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 498' ' ' HIS . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.11 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 2.54 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.55 HG22 ' HA ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 1.75 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.19 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 2.7 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.616 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 1.5 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 498' ' ' HIS . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 2.72 110.642 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.37 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 1.63 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 1.59 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 1.65 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.644 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 2.97 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.1 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.32 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.874 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.47 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.808 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.63 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.874 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 2.98 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.808 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.3 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.14 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 2.93 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.435 ' O ' HD23 ' A' ' 485' ' ' LEU . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 2.73 110.702 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 4.93 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.46 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.28 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.682 HD13 HD12 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.19 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.86 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.716 ' HB ' HD21 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.27 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.28 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.482 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 0.96 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.22 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.38 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.716 HD21 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 1.77 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 0.68 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 2.98 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 1.82 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 1.85 109.021 175.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 2.63 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.466 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.52 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 504' ' ' ILE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.09 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.11 110.226 175.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 2.54 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.609 HD12 HD23 ' A' ' 501' ' ' LEU . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 1.75 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.19 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 2.7 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 1.5 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 465' ' ' ARG . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 2.72 111.432 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.64 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.37 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 1.63 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 1.59 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 1.65 110.321 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.496 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 2.97 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.1 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.404 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4 110.207 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 5.5 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.792 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.32 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.47 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.674 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.63 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.846 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 2.98 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.3 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.14 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 2.93 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.456 HD23 HD12 ' A' ' 484' ' ' LEU . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 2.73 110.624 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.496 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 4.93 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.46 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.456 HD12 HD23 ' A' ' 481' ' ' LEU . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.28 111.963 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.84 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.19 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ASP . . . . . 0.64 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.86 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.84 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.27 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.28 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 0.96 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.22 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.38 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.77 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 0.68 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 2.98 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 1.82 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.557 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 1.85 108.809 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 2.63 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.52 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.09 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 498' ' ' HIS . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.11 109.899 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 2.54 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.563 HG22 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 1.75 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.19 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 2.7 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.632 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 1.5 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 2.72 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.518 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.37 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 1.63 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 1.59 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.698 HG21 HD23 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 1.65 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.669 ' N ' HD12 ' A' ' 468' ' ' ILE . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 2.97 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.1 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 5.5 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.32 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.553 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.47 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.63 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.524 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 2.98 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.656 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.3 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.14 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 2.93 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.698 HD23 HG21 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 2.73 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 4.93 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.46 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.28 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.912 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.19 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.86 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.912 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.27 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.28 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 0.96 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.689 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.22 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.38 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.401 ' HA ' ' HG3' ' A' ' 496' ' ' LYS . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 1.77 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 0.68 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 2.98 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.508 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 1.82 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 37.9 t60 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 1.85 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.566 ' HA ' HG12 ' A' ' 502' ' ' VAL . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 2.63 109.728 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.52 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 1.051 ' HA ' HG22 ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.09 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 499' ' ' GLN . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.11 109.483 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 2.54 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 1.051 HG22 ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 1.75 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.19 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 2.7 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.569 ' HB ' HD12 ' A' ' 464' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 1.5 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.741 HG21 ' HG ' ' A' ' 485' ' ' LEU . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 2.72 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.443 ' HG2' ' HG3' ' A' ' 482' ' ' MET . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.37 110.185 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 1.63 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 1.59 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 1.65 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.9 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 2.97 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.1 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 5.5 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.32 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.937 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.47 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.63 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.937 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 2.98 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.9 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.3 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.14 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 2.93 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.467 HD23 HD12 ' A' ' 484' ' ' LEU . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 2.73 111.237 -176.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.443 ' HG3' ' HG2' ' A' ' 465' ' ' ARG . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 4.93 109.007 173.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.46 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.28 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.741 ' HG ' HG21 ' A' ' 464' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.19 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.86 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.27 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.28 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.47 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 0.96 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.608 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.22 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.38 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.607 ' HB2' HG21 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.737 HD23 HD12 ' A' ' 485' ' ' LEU . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 1.77 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 0.68 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.476 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 1.82 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.521 ' O ' HG23 ' A' ' 502' ' ' VAL . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 1.85 109.288 176.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 2.63 109.904 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.52 110.109 174.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.731 ' HA ' HG22 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.09 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 498' ' ' HIS . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.11 109.663 175.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 2.54 111.214 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 1.75 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.636 HG23 HG23 ' A' ' 504' ' ' ILE . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.19 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 2.7 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 1.5 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.523 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 2.72 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.37 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' SER . . . . . 0.494 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 1.63 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 1.59 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 1.65 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 2.97 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.1 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 5.5 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.817 HD11 HD12 ' A' ' 505' ' ' ILE . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.32 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.709 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.47 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.63 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.409 ' HG2' ' OE1' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 2.98 112.029 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.3 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 479' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.14 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 2.93 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.69 HD12 HD11 ' A' ' 484' ' ' LEU . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 2.73 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.69 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 4.93 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.46 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.69 HD11 HD12 ' A' ' 481' ' ' LEU . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.28 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' A' ' 494' ' ' LEU . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.19 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ASP . . . . . 0.531 ' N ' HD12 ' A' ' 485' ' ' LEU . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.86 111.825 175.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 487' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' A' ' 494' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.27 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.28 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.657 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 0.96 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.22 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.38 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' A' ' 485' ' ' LEU . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 1.77 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 0.68 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 2.98 110.671 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 1.82 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.565 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 1.85 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 2.63 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.52 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.09 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 498' ' ' HIS . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.11 109.599 173.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 2.54 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.633 HG22 HG23 ' A' ' 505' ' ' ILE . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 1.75 112.143 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.817 HD12 HD11 ' A' ' 473' ' ' LEU . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.19 112.298 -172.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 2.7 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 1.5 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.608 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 2.72 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.546 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.37 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 1.63 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 1.59 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.739 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 1.65 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.739 ' N ' HD12 ' A' ' 468' ' ' ILE . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 2.97 109.525 176.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.1 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 5.5 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.688 HD11 HG21 ' A' ' 505' ' ' ILE . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.32 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.718 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.47 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.714 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.754 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.63 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 2.98 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.718 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.3 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 479' ' ' ARG . . . . . 0.754 ' HE ' ' HA ' ' A' ' 476' ' ' ASP . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.14 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 2.93 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 2.73 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.546 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 4.93 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.46 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.407 ' O ' HG12 ' A' ' 488' ' ' ILE . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.28 111.615 178.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.19 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.86 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.27 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.28 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 0.96 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.22 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.38 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 1.77 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 0.68 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 2.98 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.573 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 1.82 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' ' 502' ' ' VAL . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 1.85 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 2.63 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.528 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.52 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 468' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.09 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 498' ' ' HIS . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.11 111.033 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 2.54 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 1.75 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.688 HG21 HD11 ' A' ' 473' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.19 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 2.7 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 1.5 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.505 HD13 ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 2.72 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.37 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 1.63 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 1.59 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.618 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 1.65 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 2.97 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.1 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.489 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.703 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.32 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.703 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.47 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.837 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.879 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.63 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.879 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 2.98 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.837 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.3 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.14 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.414 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 2.93 111.149 -177.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.598 HD23 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 2.73 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 4.93 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.46 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.28 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.724 HD13 HG13 ' A' ' 488' ' ' ILE . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.19 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.86 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 487' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.724 HG13 HD13 ' A' ' 485' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.27 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.28 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.426 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 0.96 111.561 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.22 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.38 111.549 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.447 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.694 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 1.77 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 0.68 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 2.98 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 1.82 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 464' ' ' ILE . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 1.85 108.927 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.578 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 2.63 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.561 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.52 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.09 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.433 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.11 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 2.54 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 1.75 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.19 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 2.7 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 1.5 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.474 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 2.72 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.37 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 1.63 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 1.59 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 1.65 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.784 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 2.97 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.1 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.47 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 5.5 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.424 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.32 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.47 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.677 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.63 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 2.98 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.784 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.3 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.14 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 2.93 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 2.73 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 486' ' ' ASP . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 4.93 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.46 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.28 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.6 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.19 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.86 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 489' ' ' LYS . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.27 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.766 ' HG2' HG22 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.28 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.476 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 0.96 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.698 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.22 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.38 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.44 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 491' ' ' ALA . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 1.77 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 0.68 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 2.98 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 1.82 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.54 ' O ' HG23 ' A' ' 502' ' ' VAL . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 1.85 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 2.63 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.506 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.52 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 504' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.09 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 498' ' ' HIS . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.11 109.942 174.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 2.54 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.651 HD12 HD13 ' A' ' 501' ' ' LEU . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 1.75 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 505' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.19 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' SER . . . . . 0.455 ' HA ' ' HB3' ' A' ' 465' ' ' ARG . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 2.7 110.868 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 1.5 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.964 HD13 ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 2.72 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.455 ' HB3' ' HA ' ' A' ' 462' ' ' SER . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.37 110.361 173.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 1.63 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 1.59 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.532 HG22 HD12 ' A' ' 501' ' ' LEU . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 1.65 109.822 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 469' ' ' LYS . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 2.97 111.567 178.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.1 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.419 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 472' ' ' ARG . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 5.5 111.925 -173.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.627 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.32 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.946 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.47 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.885 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.63 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.946 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 2.98 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.885 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.3 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.14 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 2.93 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 484' ' ' LEU . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 2.73 111.734 -174.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.437 ' HG3' ' HD2' ' A' ' 469' ' ' LYS . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 4.93 109.15 175.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.46 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 481' ' ' LEU . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.28 111.347 174.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.797 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.19 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.86 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.797 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.27 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.28 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 0.96 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.22 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.38 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 1.77 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.563 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 0.68 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.562 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 2.98 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.562 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 1.82 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.964 ' HA ' HD13 ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 1.85 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 2.63 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.554 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.52 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 504' ' ' ILE . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.09 111.91 -172.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.11 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 2.54 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 501' ' ' LEU . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 1.75 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.19 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 2.7 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.5 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.493 HG12 ' HB2' ' A' ' 498' ' ' HIS . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 2.72 110.384 -175.83 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.37 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 1.63 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 463' ' ' VAL . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 1.59 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.971 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 1.65 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.675 ' N ' HD12 ' A' ' 468' ' ' ILE . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 2.97 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.1 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' ARG . . . . . 0.617 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 5.5 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.817 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.32 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.817 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.47 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 1.065 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 476' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.63 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 2.98 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 1.065 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.3 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 479' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.14 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 2.93 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 2.73 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.488 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 4.93 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.46 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 488' ' ' ILE . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.28 111.107 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.968 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.19 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.86 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.968 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.27 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.28 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 0.96 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.22 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.38 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.745 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 1.77 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 0.68 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 2.98 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 1.82 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.493 ' HB2' HG12 ' A' ' 464' ' ' ILE . 77.0 t60 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 1.85 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.631 ' HA ' HG12 ' A' ' 502' ' ' VAL . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 2.63 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.513 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.52 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 468' ' ' ILE . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.09 110.998 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.631 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.11 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 2.54 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 501' ' ' LEU . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 1.75 109.672 171.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.19 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 2.7 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 1.5 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 498' ' ' HIS . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 2.72 111.247 -175.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.438 ' HD3' ' HG3' ' A' ' 482' ' ' MET . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.37 110.28 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 1.63 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.559 HD12 HD13 ' A' ' 464' ' ' ILE . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 1.59 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.72 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 1.65 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.72 ' N ' HD12 ' A' ' 468' ' ' ILE . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 2.97 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.1 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 473' ' ' LEU . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 5.5 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 1.022 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.32 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 1.022 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.47 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.63 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 477' ' ' ARG . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 2.98 110.952 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.3 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.14 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.516 ' CZ ' HD11 ' A' ' 484' ' ' LEU . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 2.93 110.786 -179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 481' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 2.73 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.572 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 4.93 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.46 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.28 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.625 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.19 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.86 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.625 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.27 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.28 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 0.96 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.22 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.38 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' ASP . . . . . 0.5 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 1.77 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 0.68 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 2.98 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 1.82 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.632 ' HB2' HD11 ' A' ' 464' ' ' ILE . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 1.85 108.125 176.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 2.63 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.582 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.52 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.09 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.11 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 1.75 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.19 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 2.7 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 1.5 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.712 HD11 HD21 ' A' ' 501' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 2.72 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 1.037 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.37 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 466' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 1.63 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 1.59 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 1.65 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 469' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 468' ' ' ILE . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 2.97 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.1 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' ARG . . . . . 0.494 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 5.5 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.688 HD23 ' HB3' ' A' ' 478' ' ' LYS . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.32 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.562 ' OE1' HD12 ' A' ' 473' ' ' LEU . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.47 112.262 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.454 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.63 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 2.98 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HB3' HD23 ' A' ' 473' ' ' LEU . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.3 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.14 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 2.93 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 2.73 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 482' ' ' MET . . . . . 1.037 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 4.93 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.46 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.28 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.898 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.19 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.86 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.898 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.27 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 489' ' ' LYS . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.28 110.534 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 0.96 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.22 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.38 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.436 HD12 ' N ' ' A' ' 495' ' ' ALA . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 1.77 110.227 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.436 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 0.68 109.421 173.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 496' ' ' LYS . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 2.98 109.919 175.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 497' ' ' PHE . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 1.82 109.693 177.223 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 1.85 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.63 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.72 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.52 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.712 HD21 HD11 ' A' ' 464' ' ' ILE . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.09 112.258 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.454 ' N ' HD12 ' A' ' 501' ' ' LEU . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.11 110.516 178.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 2.54 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 1.75 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.19 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 2.7 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 463' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 1.5 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 464' ' ' ILE . . . . . 0.483 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 2.72 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.37 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 1.63 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 1.59 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ILE . . . . . 0.555 HD11 HD23 ' A' ' 485' ' ' LEU . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 1.65 110.656 -176.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 2.97 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.1 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 472' ' ' ARG . . . . . 0.504 ' HD3' ' HA ' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 5.5 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.32 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.763 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.47 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.738 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.63 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' ARG . . . . . 0.763 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 2.98 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.738 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.3 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.14 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' TYR . . . . . 0.502 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 2.93 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 481' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 2.73 110.991 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 482' ' ' MET . . . . . 0.621 ' HA ' HD23 ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 4.93 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.46 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.28 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.19 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.86 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.27 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.28 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' GLY . . . . . 0.469 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 0.96 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.22 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.38 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 1.77 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.623 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 0.68 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 2.98 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 497' ' ' PHE . . . . . 0.575 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 1.82 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 498' ' ' HIS . . . . . 0.623 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 1.85 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 499' ' ' GLN . . . . . 0.726 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 2.63 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 500' ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' ' 497' ' ' PHE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.52 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 501' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.09 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 502' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.11 110.484 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.726 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 2.54 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 504' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 1.75 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.19 111.016 -178.226 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 2.7 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.518 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 1.5 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.886 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 2.72 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.703 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.37 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 1.63 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.697 HG21 ' CE1' ' A' ' 498' ' ' HIS . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 1.59 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.649 HD13 HD12 ' A' ' 485' ' ' LEU . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 1.65 110.499 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.702 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 2.97 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.1 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.562 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 5.5 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.652 HD12 ' HG2' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.32 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.652 ' HG2' HD12 ' A' ' 473' ' ' LEU . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.47 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.551 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.63 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.604 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 2.98 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.3 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.14 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.514 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 2.93 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 2.73 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.703 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 4.93 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.495 HG22 ' O ' ' A' ' 480' ' ' TYR . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.46 110.609 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.28 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 468' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.19 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.86 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.66 ' HB ' HD21 ' A' ' 494' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.27 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 489' ' ' LYS . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.28 111.319 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.404 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 0.96 111.26 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.22 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.38 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.886 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 1.77 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 0.68 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 2.98 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 1.82 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.79 ' HB2' HD12 ' A' ' 464' ' ' ILE . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 1.85 109.024 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 2.63 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.571 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.52 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' A' ' 504' ' ' ILE . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.09 112.52 -173.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.476 ' N ' HD12 ' A' ' 501' ' ' LEU . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.11 110.248 -178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 2.54 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 1.75 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.488 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.19 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 2.7 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 467' ' ' ILE . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 1.5 110.891 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.916 HD13 ' HA ' ' A' ' 498' ' ' HIS . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 2.72 110.869 -178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.37 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 1.63 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.457 ' HB ' HD12 ' A' ' 464' ' ' ILE . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 1.59 111.163 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 1.008 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 1.65 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.601 ' N ' HD12 ' A' ' 468' ' ' ILE . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 2.97 110.825 176.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.1 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 5.5 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 478' ' ' LYS . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.32 107.945 170.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.47 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.63 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.493 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 1.008 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.3 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.14 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 2.93 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 2.73 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 485' ' ' LEU . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 4.93 110.505 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.46 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.494 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.28 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.19 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.86 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.819 HG22 ' H ' ' A' ' 490' ' ' GLY . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.27 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.28 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.819 ' H ' HG22 ' A' ' 488' ' ' ILE . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 0.96 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.22 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.38 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 1.77 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.467 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 0.68 110.053 176.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 2.98 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 1.82 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.916 ' HA ' HD13 ' A' ' 464' ' ' ILE . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 1.85 109.1 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.651 ' HA ' HG12 ' A' ' 502' ' ' VAL . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 2.63 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.444 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.52 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.757 ' HA ' HG22 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.09 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.651 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.11 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 2.54 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 1.75 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.19 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 2.7 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 1.5 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.664 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 2.72 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.448 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.37 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 1.63 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 1.59 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.569 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 1.65 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.521 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 2.97 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.1 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ARG . . . . . 0.735 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 5.5 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.816 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.32 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.816 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.47 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.702 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.63 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.681 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 2.98 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.3 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.14 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 2.93 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 2.73 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 4.93 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.46 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.28 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.844 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.19 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ASP . . . . . 0.448 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.86 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.844 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.27 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.28 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.596 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 0.96 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.474 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.22 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.38 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.729 HD12 ' N ' ' A' ' 495' ' ' ALA . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 1.77 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.729 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.68 109.823 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 2.98 110.257 177.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 500' ' ' MET . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 1.82 110.193 174.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.664 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 1.85 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 2.63 109.566 172.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.52 110.445 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.737 ' HA ' HG22 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.09 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 498' ' ' HIS . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.11 109.661 173.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 2.54 111.151 175.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.737 HG22 ' HA ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 1.75 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.693 HG23 HG23 ' A' ' 504' ' ' ILE . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.19 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 2.7 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 1.5 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.608 HD11 ' HB2' ' A' ' 498' ' ' HIS . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 2.72 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.37 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 1.63 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 1.59 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.919 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 1.65 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.687 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 2.97 110.536 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.1 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.53 HD13 HD13 ' A' ' 505' ' ' ILE . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.32 111.198 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.47 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.514 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.63 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 2.98 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.919 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.3 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' ARG . . . . . 0.514 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.14 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 2.93 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.703 HD13 HG21 ' A' ' 468' ' ' ILE . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 2.73 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.639 ' HB3' HD11 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 4.93 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.46 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.28 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.721 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.19 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.86 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.721 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.27 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.28 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.45 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 0.96 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.22 113.853 -166.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.38 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.583 HD23 HD11 ' A' ' 485' ' ' LEU . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 1.77 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 0.68 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 500' ' ' MET . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 2.98 110.298 178.442 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 1.82 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.608 ' HB2' HD11 ' A' ' 464' ' ' ILE . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 1.85 109.013 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 2.63 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.646 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.52 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 502' ' ' VAL . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.09 111.486 -176.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.414 ' N ' HD12 ' A' ' 501' ' ' LEU . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.11 110.633 176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.831 HG22 HG23 ' A' ' 505' ' ' ILE . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 1.75 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.831 HG23 HG22 ' A' ' 504' ' ' ILE . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.19 112.777 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 2.7 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 1.5 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 485' ' ' LEU . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 2.72 110.861 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.37 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 1.63 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 1.59 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 1.65 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 2.97 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.1 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 5.5 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.32 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.608 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.47 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.45 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.63 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.608 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 2.98 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.3 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.14 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 2.93 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 497' ' ' PHE . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 2.73 111.816 -176.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.54 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 4.93 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.46 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 488' ' ' ILE . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.28 110.582 173.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.19 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.86 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.27 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.28 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 0.96 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.42 ' HA ' HD21 ' A' ' 494' ' ' LEU . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.22 110.447 176.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.38 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 488' ' ' ILE . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 1.77 111.598 -175.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 0.68 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 2.98 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HB3' HD11 ' A' ' 481' ' ' LEU . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 1.82 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 502' ' ' VAL . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 1.85 109.752 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 2.63 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.545 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.52 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.09 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 498' ' ' HIS . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.11 110.262 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 2.54 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 1.75 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.19 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 2.7 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 1.5 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.661 HG23 HD11 ' A' ' 485' ' ' LEU . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 2.72 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 465' ' ' ARG . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.37 110.74 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 1.63 110.756 -177.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 1.59 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 1.65 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 2.97 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.1 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 5.5 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.32 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.771 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.47 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 478' ' ' LYS . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.63 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 2.98 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.3 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.14 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 2.93 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 2.73 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.602 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 4.93 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.46 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.28 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.661 HD11 HG23 ' A' ' 464' ' ' ILE . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.19 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.86 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.827 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.27 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.28 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 0.96 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.22 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.38 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.827 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 1.77 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.446 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 0.68 109.824 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 2.98 109.68 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 1.82 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.527 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 1.85 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 2.63 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.52 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.09 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 498' ' ' HIS . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.11 110.094 173.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 2.54 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 1.75 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.19 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 2.7 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 1.5 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.61 ' H ' HD12 ' A' ' 464' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 2.72 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.37 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 1.63 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 1.59 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.517 HG23 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 1.65 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.759 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 2.97 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.1 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB2' HD21 ' A' ' 473' ' ' LEU . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4 109.985 173.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 5.5 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.676 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.32 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.676 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.47 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.978 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.63 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.484 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 2.98 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.978 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.3 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.14 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 2.93 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 2.73 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 4.93 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.46 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.54 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.28 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.501 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.19 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.86 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.27 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.28 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 0.96 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.22 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.38 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.472 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 1.77 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.68 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 2.98 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 1.82 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.533 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 1.85 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 2.63 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.52 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HA ' HG22 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.09 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 498' ' ' HIS . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.11 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 2.54 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.55 HG22 ' HA ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 1.75 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.19 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 2.7 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.616 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 1.5 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 498' ' ' HIS . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 2.72 110.642 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.37 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 1.63 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 1.59 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 1.65 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.644 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 2.97 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.1 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.32 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.874 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.47 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.808 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.63 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.874 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 2.98 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.808 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.3 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.14 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 2.93 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.435 ' O ' HD23 ' A' ' 485' ' ' LEU . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 2.73 110.702 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 4.93 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.46 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.28 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.682 HD13 HD12 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.19 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.86 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.716 ' HB ' HD21 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.27 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.28 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.482 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 0.96 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.22 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.38 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.716 HD21 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 1.77 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 0.68 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 2.98 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 1.82 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 1.85 109.021 175.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 2.63 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.466 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.52 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 504' ' ' ILE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.09 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.11 110.226 175.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 2.54 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.609 HD12 HD23 ' A' ' 501' ' ' LEU . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 1.75 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.19 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 2.7 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 1.5 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 465' ' ' ARG . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 2.72 111.432 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.64 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.37 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 1.63 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 1.59 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 1.65 110.321 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.496 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 2.97 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.1 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.404 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4 110.207 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 5.5 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.792 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.32 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.47 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.674 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.63 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.846 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 2.98 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.3 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.14 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 2.93 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.456 HD23 HD12 ' A' ' 484' ' ' LEU . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 2.73 110.624 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.496 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 4.93 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.46 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.456 HD12 HD23 ' A' ' 481' ' ' LEU . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.28 111.963 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.84 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.19 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ASP . . . . . 0.64 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.86 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.84 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.27 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.28 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 0.96 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.22 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.38 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.77 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 0.68 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 2.98 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 1.82 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.557 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 1.85 108.809 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 2.63 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.52 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.09 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 498' ' ' HIS . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.11 109.899 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 2.54 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.563 HG22 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 1.75 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.19 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 2.7 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.632 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 1.5 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 2.72 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.518 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.37 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 1.63 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 1.59 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.698 HG21 HD23 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 1.65 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.669 ' N ' HD12 ' A' ' 468' ' ' ILE . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 2.97 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.1 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 5.5 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.32 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.553 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.47 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.63 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.524 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 2.98 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.656 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.3 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.14 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 2.93 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.698 HD23 HG21 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 2.73 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 4.93 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.46 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.28 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.912 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.19 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.86 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.912 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.27 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.28 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 0.96 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.689 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.22 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.38 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.401 ' HA ' ' HG3' ' A' ' 496' ' ' LYS . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 1.77 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 0.68 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 2.98 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.508 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 1.82 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 37.9 t60 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 1.85 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.566 ' HA ' HG12 ' A' ' 502' ' ' VAL . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 2.63 109.728 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.52 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 1.051 ' HA ' HG22 ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.09 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 499' ' ' GLN . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.11 109.483 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 2.54 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 1.051 HG22 ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 1.75 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.19 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 2.7 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.569 ' HB ' HD12 ' A' ' 464' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 1.5 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.741 HG21 ' HG ' ' A' ' 485' ' ' LEU . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 2.72 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.443 ' HG2' ' HG3' ' A' ' 482' ' ' MET . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.37 110.185 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 1.63 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 1.59 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 1.65 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.9 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 2.97 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.1 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 5.5 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.32 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.937 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.47 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.63 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.937 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 2.98 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.9 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.3 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.14 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 2.93 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.467 HD23 HD12 ' A' ' 484' ' ' LEU . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 2.73 111.237 -176.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.443 ' HG3' ' HG2' ' A' ' 465' ' ' ARG . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 4.93 109.007 173.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.46 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.28 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.741 ' HG ' HG21 ' A' ' 464' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.19 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.86 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.27 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.28 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.47 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 0.96 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.608 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.22 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.38 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.607 ' HB2' HG21 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.737 HD23 HD12 ' A' ' 485' ' ' LEU . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 1.77 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 0.68 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.476 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 1.82 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.521 ' O ' HG23 ' A' ' 502' ' ' VAL . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 1.85 109.288 176.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 2.63 109.904 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.52 110.109 174.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.731 ' HA ' HG22 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.09 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 498' ' ' HIS . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.11 109.663 175.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 2.54 111.214 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 1.75 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.636 HG23 HG23 ' A' ' 504' ' ' ILE . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.19 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 2.7 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 1.5 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.523 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 2.72 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.37 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' SER . . . . . 0.494 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 1.63 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 1.59 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 1.65 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 2.97 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.1 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 5.5 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.817 HD11 HD12 ' A' ' 505' ' ' ILE . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.32 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.709 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.47 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.63 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.409 ' HG2' ' OE1' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 2.98 112.029 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.3 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.14 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 2.93 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.69 HD12 HD11 ' A' ' 484' ' ' LEU . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 2.73 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.69 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 4.93 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.46 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.69 HD11 HD12 ' A' ' 481' ' ' LEU . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.28 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' A' ' 494' ' ' LEU . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.19 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ASP . . . . . 0.531 ' N ' HD12 ' A' ' 485' ' ' LEU . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.86 111.825 175.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 487' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' A' ' 494' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.27 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.28 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.657 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 0.96 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.22 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.38 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' A' ' 485' ' ' LEU . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 1.77 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 0.68 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 2.98 110.671 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 1.82 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.565 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 1.85 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 2.63 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.52 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.09 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 498' ' ' HIS . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.11 109.599 173.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 2.54 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.633 HG22 HG23 ' A' ' 505' ' ' ILE . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 1.75 112.143 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.817 HD12 HD11 ' A' ' 473' ' ' LEU . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.19 112.298 -172.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 2.7 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 1.5 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.608 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 2.72 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.546 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.37 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 1.63 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 1.59 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.739 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 1.65 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.739 ' N ' HD12 ' A' ' 468' ' ' ILE . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 2.97 109.525 176.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.1 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 5.5 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.688 HD11 HG21 ' A' ' 505' ' ' ILE . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.32 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.718 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.47 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.714 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.754 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.63 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 2.98 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.718 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.3 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 479' ' ' ARG . . . . . 0.754 ' HE ' ' HA ' ' A' ' 476' ' ' ASP . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.14 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 2.93 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 2.73 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.546 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 4.93 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.46 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.407 ' O ' HG12 ' A' ' 488' ' ' ILE . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.28 111.615 178.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.19 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.86 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.27 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.28 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 0.96 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.22 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.38 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 1.77 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 0.68 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 2.98 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.573 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 1.82 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' ' 502' ' ' VAL . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 1.85 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 2.63 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.528 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.52 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 468' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.09 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 498' ' ' HIS . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.11 111.033 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 2.54 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 1.75 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.688 HG21 HD11 ' A' ' 473' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.19 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 2.7 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 1.5 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.505 HD13 ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 2.72 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.37 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 1.63 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 1.59 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.618 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 1.65 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 2.97 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.1 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.489 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.703 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.32 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.703 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.47 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.837 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.879 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.63 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.879 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 2.98 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.837 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.3 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.14 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.414 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 2.93 111.149 -177.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.598 HD23 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 2.73 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 4.93 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.46 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.28 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.724 HD13 HG13 ' A' ' 488' ' ' ILE . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.19 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.86 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.724 HG13 HD13 ' A' ' 485' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.27 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.28 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.426 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 0.96 111.561 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.22 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.38 111.549 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.447 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.694 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 1.77 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 0.68 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 2.98 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 1.82 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 464' ' ' ILE . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 1.85 108.927 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.578 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 2.63 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.561 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.52 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.09 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.433 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.11 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 2.54 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 1.75 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.19 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 2.7 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 1.5 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.474 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 2.72 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.37 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 1.63 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 1.59 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 1.65 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.784 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 2.97 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.1 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.47 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 5.5 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.424 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.32 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.47 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.677 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.63 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 2.98 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.784 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.3 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.14 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 2.93 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 2.73 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 486' ' ' ASP . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 4.93 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.46 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.28 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.6 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.19 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.86 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 489' ' ' LYS . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.27 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.766 ' HG2' HG22 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.28 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.476 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 0.96 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.698 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.22 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.38 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.44 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 491' ' ' ALA . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 1.77 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 0.68 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 2.98 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 1.82 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.54 ' O ' HG23 ' A' ' 502' ' ' VAL . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 1.85 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 2.63 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.506 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.52 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 504' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.09 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 498' ' ' HIS . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.11 109.942 174.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 2.54 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.651 HD12 HD13 ' A' ' 501' ' ' LEU . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 1.75 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 505' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.19 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' SER . . . . . 0.455 ' HA ' ' HB3' ' A' ' 465' ' ' ARG . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 2.7 110.868 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 1.5 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.964 HD13 ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 2.72 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.455 ' HB3' ' HA ' ' A' ' 462' ' ' SER . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.37 110.361 173.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 1.63 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 1.59 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.532 HG22 HD12 ' A' ' 501' ' ' LEU . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 1.65 109.822 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 469' ' ' LYS . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 2.97 111.567 178.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.1 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.419 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 472' ' ' ARG . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 5.5 111.925 -173.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.627 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.32 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.946 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.47 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.885 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.63 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.946 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 2.98 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.885 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.3 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.14 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 2.93 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 484' ' ' LEU . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 2.73 111.734 -174.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.437 ' HG3' ' HD2' ' A' ' 469' ' ' LYS . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 4.93 109.15 175.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.46 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 481' ' ' LEU . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.28 111.347 174.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.797 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.19 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.86 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.797 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.27 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.28 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 0.96 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.22 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.38 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 1.77 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.563 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 0.68 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.562 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 2.98 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.562 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 1.82 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.964 ' HA ' HD13 ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 1.85 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 2.63 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.554 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.52 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 504' ' ' ILE . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.09 111.91 -172.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.11 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 2.54 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 501' ' ' LEU . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 1.75 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.19 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 2.7 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.5 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.493 HG12 ' HB2' ' A' ' 498' ' ' HIS . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 2.72 110.384 -175.83 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.37 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 1.63 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 463' ' ' VAL . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 1.59 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.971 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 1.65 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.675 ' N ' HD12 ' A' ' 468' ' ' ILE . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 2.97 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.1 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' ARG . . . . . 0.617 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 5.5 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.817 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.32 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.817 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.47 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 1.065 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.63 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 2.98 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 1.065 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.3 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.14 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 2.93 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 2.73 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.488 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 4.93 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.46 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 488' ' ' ILE . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.28 111.107 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.968 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.19 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.86 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.968 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.27 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.28 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 0.96 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.22 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.38 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.745 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 1.77 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 0.68 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 2.98 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 1.82 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.493 ' HB2' HG12 ' A' ' 464' ' ' ILE . 77.0 t60 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 1.85 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.631 ' HA ' HG12 ' A' ' 502' ' ' VAL . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 2.63 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.513 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.52 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 468' ' ' ILE . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.09 110.998 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.631 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.11 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 2.54 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 501' ' ' LEU . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 1.75 109.672 171.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.19 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 2.7 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 1.5 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 498' ' ' HIS . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 2.72 111.247 -175.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.438 ' HD3' ' HG3' ' A' ' 482' ' ' MET . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.37 110.28 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 1.63 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.559 HD12 HD13 ' A' ' 464' ' ' ILE . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 1.59 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.72 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 1.65 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.72 ' N ' HD12 ' A' ' 468' ' ' ILE . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 2.97 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.1 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 473' ' ' LEU . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 5.5 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 1.022 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.32 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 1.022 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.47 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.63 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 477' ' ' ARG . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 2.98 110.952 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.3 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.14 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.516 ' CZ ' HD11 ' A' ' 484' ' ' LEU . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 2.93 110.786 -179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 481' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 2.73 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.572 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 4.93 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.46 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.28 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.625 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.19 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.86 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.625 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.27 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.28 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 0.96 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.22 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.38 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' ASP . . . . . 0.5 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 1.77 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 0.68 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 2.98 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 1.82 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.632 ' HB2' HD11 ' A' ' 464' ' ' ILE . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 1.85 108.125 176.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 2.63 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.582 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.52 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.09 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.11 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 1.75 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.19 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 2.7 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 1.5 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.712 HD11 HD21 ' A' ' 501' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 2.72 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 1.037 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.37 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 466' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 1.63 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 1.59 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 1.65 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 469' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 468' ' ' ILE . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 2.97 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.1 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' ARG . . . . . 0.494 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 5.5 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.688 HD23 ' HB3' ' A' ' 478' ' ' LYS . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.32 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.562 ' OE1' HD12 ' A' ' 473' ' ' LEU . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.47 112.262 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.454 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.63 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 2.98 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HB3' HD23 ' A' ' 473' ' ' LEU . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.3 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.14 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 2.93 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 2.73 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 482' ' ' MET . . . . . 1.037 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 4.93 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.46 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.28 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.898 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.19 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.86 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.898 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.27 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 489' ' ' LYS . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.28 110.534 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 0.96 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.22 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.38 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.436 HD12 ' N ' ' A' ' 495' ' ' ALA . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 1.77 110.227 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.436 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 0.68 109.421 173.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 496' ' ' LYS . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 2.98 109.919 175.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 497' ' ' PHE . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 1.82 109.693 177.223 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 1.85 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.63 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.72 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.52 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.712 HD21 HD11 ' A' ' 464' ' ' ILE . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.09 112.258 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.454 ' N ' HD12 ' A' ' 501' ' ' LEU . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.11 110.516 178.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 2.54 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 1.75 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.19 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 2.7 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 463' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 1.5 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 464' ' ' ILE . . . . . 0.483 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 2.72 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.37 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 1.63 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 1.59 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ILE . . . . . 0.555 HD11 HD23 ' A' ' 485' ' ' LEU . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 1.65 110.656 -176.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 2.97 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.1 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 472' ' ' ARG . . . . . 0.504 ' HD3' ' HA ' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 5.5 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.32 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.763 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.47 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.738 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.63 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' ARG . . . . . 0.763 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 2.98 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.738 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.3 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.14 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' TYR . . . . . 0.502 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 2.93 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 481' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 2.73 110.991 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 482' ' ' MET . . . . . 0.621 ' HA ' HD23 ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 4.93 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.46 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.28 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.19 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.86 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.27 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.28 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' GLY . . . . . 0.469 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 0.96 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.22 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.38 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 1.77 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.623 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 0.68 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 2.98 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 497' ' ' PHE . . . . . 0.575 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 1.82 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 498' ' ' HIS . . . . . 0.623 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 1.85 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 499' ' ' GLN . . . . . 0.726 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 2.63 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 500' ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' ' 497' ' ' PHE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.52 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 501' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.09 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 502' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.11 110.484 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.726 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 2.54 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 504' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 1.75 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.19 111.016 -178.226 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 2.7 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.518 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 1.5 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.886 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 2.72 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.703 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.37 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 1.63 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.697 HG21 ' CE1' ' A' ' 498' ' ' HIS . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 1.59 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.649 HD13 HD12 ' A' ' 485' ' ' LEU . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 1.65 110.499 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.702 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 2.97 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.1 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.562 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 5.5 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.652 HD12 ' HG2' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.32 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.652 ' HG2' HD12 ' A' ' 473' ' ' LEU . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.47 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.551 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.63 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.604 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 2.98 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.3 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.14 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.514 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 2.93 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 2.73 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.703 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 4.93 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.495 HG22 ' O ' ' A' ' 480' ' ' TYR . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.46 110.609 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.28 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 468' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.19 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.86 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.66 ' HB ' HD21 ' A' ' 494' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.27 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 489' ' ' LYS . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.28 111.319 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.404 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 0.96 111.26 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.22 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.38 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.886 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 1.77 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 0.68 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 2.98 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 1.82 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.79 ' HB2' HD12 ' A' ' 464' ' ' ILE . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 1.85 109.024 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 2.63 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.571 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.52 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' A' ' 504' ' ' ILE . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.09 112.52 -173.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.476 ' N ' HD12 ' A' ' 501' ' ' LEU . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.11 110.248 -178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 2.54 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 1.75 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.488 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.19 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 2.7 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 467' ' ' ILE . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 1.5 110.891 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.916 HD13 ' HA ' ' A' ' 498' ' ' HIS . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 2.72 110.869 -178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.37 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 1.63 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.457 ' HB ' HD12 ' A' ' 464' ' ' ILE . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 1.59 111.163 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 1.008 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 1.65 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.601 ' N ' HD12 ' A' ' 468' ' ' ILE . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 2.97 110.825 176.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.1 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 5.5 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 478' ' ' LYS . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.32 107.945 170.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.47 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.63 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.493 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 1.008 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.3 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.14 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 2.93 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 2.73 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 485' ' ' LEU . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 4.93 110.505 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.46 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.494 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.28 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.19 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.86 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.819 HG22 ' H ' ' A' ' 490' ' ' GLY . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.27 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.28 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.819 ' H ' HG22 ' A' ' 488' ' ' ILE . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 0.96 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.22 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.38 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 1.77 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.467 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 0.68 110.053 176.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 2.98 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 1.82 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.916 ' HA ' HD13 ' A' ' 464' ' ' ILE . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 1.85 109.1 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.651 ' HA ' HG12 ' A' ' 502' ' ' VAL . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 2.63 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.444 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.52 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.757 ' HA ' HG22 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.09 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.651 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.11 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 2.54 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 1.75 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.19 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 2.7 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 1.5 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.664 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 2.72 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.448 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.37 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 1.63 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 1.59 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.569 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 1.65 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.521 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 2.97 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.1 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . 0.735 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 5.5 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.816 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.32 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.816 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.47 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.702 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.63 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.681 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 2.98 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.3 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.14 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 2.93 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 2.73 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 4.93 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.46 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.28 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.844 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.19 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . 0.448 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.86 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.844 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.27 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.28 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.596 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 0.96 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.474 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.22 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.38 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.729 HD12 ' N ' ' A' ' 495' ' ' ALA . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 1.77 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.729 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.68 109.823 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 2.98 110.257 177.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 500' ' ' MET . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 1.82 110.193 174.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.664 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 1.85 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 2.63 109.566 172.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.52 110.445 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.737 ' HA ' HG22 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.09 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 498' ' ' HIS . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.11 109.661 173.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 2.54 111.151 175.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.737 HG22 ' HA ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 1.75 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.693 HG23 HG23 ' A' ' 504' ' ' ILE . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.19 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 2.7 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 1.5 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.608 HD11 ' HB2' ' A' ' 498' ' ' HIS . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 2.72 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.37 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 1.63 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 1.59 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.919 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 1.65 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.687 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 2.97 110.536 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.1 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.53 HD13 HD13 ' A' ' 505' ' ' ILE . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.32 111.198 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.47 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.514 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.63 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 2.98 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.919 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.3 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . 0.514 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.14 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 2.93 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.703 HD13 HG21 ' A' ' 468' ' ' ILE . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 2.73 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.639 ' HB3' HD11 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 4.93 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.46 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.28 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.721 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.19 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.86 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.721 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.27 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.28 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.45 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 0.96 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.22 113.853 -166.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.38 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.583 HD23 HD11 ' A' ' 485' ' ' LEU . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 1.77 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 0.68 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 500' ' ' MET . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 2.98 110.298 178.442 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 1.82 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.608 ' HB2' HD11 ' A' ' 464' ' ' ILE . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 1.85 109.013 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 2.63 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.646 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.52 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 502' ' ' VAL . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.09 111.486 -176.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.414 ' N ' HD12 ' A' ' 501' ' ' LEU . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.11 110.633 176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.831 HG22 HG23 ' A' ' 505' ' ' ILE . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 1.75 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.831 HG23 HG22 ' A' ' 504' ' ' ILE . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.19 112.777 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 2.7 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 1.5 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 485' ' ' LEU . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 2.72 110.861 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.37 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 1.63 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 1.59 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 1.65 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 2.97 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.1 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 5.5 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.32 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.608 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.47 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.45 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.63 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.608 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 2.98 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.3 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.14 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 2.93 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 497' ' ' PHE . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 2.73 111.816 -176.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.54 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 4.93 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.46 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 488' ' ' ILE . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.28 110.582 173.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.19 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.86 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.27 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.28 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 0.96 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.42 ' HA ' HD21 ' A' ' 494' ' ' LEU . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.22 110.447 176.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.38 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 488' ' ' ILE . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 1.77 111.598 -175.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 0.68 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 2.98 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HB3' HD11 ' A' ' 481' ' ' LEU . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 1.82 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 502' ' ' VAL . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 1.85 109.752 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 2.63 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.545 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.52 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.09 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 498' ' ' HIS . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.11 110.262 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 2.54 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 1.75 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.19 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 2.7 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 1.5 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.661 HG23 HD11 ' A' ' 485' ' ' LEU . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 2.72 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 465' ' ' ARG . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.37 110.74 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 1.63 110.756 -177.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 1.59 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 1.65 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 2.97 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.1 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 5.5 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.32 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.771 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.47 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 478' ' ' LYS . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.63 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 2.98 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.3 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.14 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 2.93 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 2.73 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.602 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 4.93 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.46 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.28 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.661 HD11 HG23 ' A' ' 464' ' ' ILE . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.19 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.86 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.827 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.27 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.28 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 0.96 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.22 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.38 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.827 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 1.77 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.446 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 0.68 109.824 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 2.98 109.68 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 1.82 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.527 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 1.85 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 2.63 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.52 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.09 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 498' ' ' HIS . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.11 110.094 173.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 2.54 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 1.75 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.19 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 2.7 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 1.5 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.61 ' H ' HD12 ' A' ' 464' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 2.72 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.37 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 1.63 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 1.59 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.517 HG23 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 1.65 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.759 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 2.97 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.1 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB2' HD21 ' A' ' 473' ' ' LEU . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4 109.985 173.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 5.5 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.676 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.32 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.676 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.47 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.978 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.63 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.484 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 2.98 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.978 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.3 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.14 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 2.93 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 2.73 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 4.93 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.46 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.54 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.28 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.501 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.19 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.86 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.27 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.28 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 0.96 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.22 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.38 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.472 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 1.77 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.68 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 2.98 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 1.82 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.533 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 1.85 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 2.63 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.52 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HA ' HG22 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.09 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 498' ' ' HIS . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.11 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 2.54 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.55 HG22 ' HA ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 1.75 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.19 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 2.7 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.616 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 1.5 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 498' ' ' HIS . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 2.72 110.642 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.37 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 1.63 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 1.59 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 1.65 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.644 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 2.97 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.1 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.32 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.874 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.47 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.808 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.63 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.874 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 2.98 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.808 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.3 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.14 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 2.93 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.435 ' O ' HD23 ' A' ' 485' ' ' LEU . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 2.73 110.702 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 4.93 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.46 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.28 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.682 HD13 HD12 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.19 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.86 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.716 ' HB ' HD21 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.27 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.28 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.482 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 0.96 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.22 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.38 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.716 HD21 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 1.77 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 0.68 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 2.98 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 1.82 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 1.85 109.021 175.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 2.63 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.466 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.52 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 504' ' ' ILE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.09 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.11 110.226 175.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 2.54 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.609 HD12 HD23 ' A' ' 501' ' ' LEU . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 1.75 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.19 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 2.7 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 1.5 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 465' ' ' ARG . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 2.72 111.432 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.64 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.37 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 1.63 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 1.59 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 1.65 110.321 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.496 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 2.97 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.1 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.404 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4 110.207 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 5.5 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.792 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.32 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.47 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.674 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.63 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.846 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 2.98 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.3 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.14 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 2.93 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.456 HD23 HD12 ' A' ' 484' ' ' LEU . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 2.73 110.624 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.496 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 4.93 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.46 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.456 HD12 HD23 ' A' ' 481' ' ' LEU . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.28 111.963 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.84 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.19 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . 0.64 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.86 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.84 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.27 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.28 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 0.96 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.22 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.38 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.77 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 0.68 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 2.98 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 1.82 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.557 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 1.85 108.809 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 2.63 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.52 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.09 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 498' ' ' HIS . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.11 109.899 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 2.54 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.563 HG22 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 1.75 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.19 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 2.7 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.632 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 1.5 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 2.72 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.518 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.37 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 1.63 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 1.59 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.698 HG21 HD23 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 1.65 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.669 ' N ' HD12 ' A' ' 468' ' ' ILE . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 2.97 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.1 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 5.5 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.32 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.553 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.47 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.63 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.524 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 2.98 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.656 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.3 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.14 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 2.93 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.698 HD23 HG21 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 2.73 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 4.93 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.46 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.28 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.912 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.19 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.86 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.912 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.27 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.28 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 0.96 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.689 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.22 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.38 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.401 ' HA ' ' HG3' ' A' ' 496' ' ' LYS . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 1.77 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 0.68 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 2.98 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.508 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 1.82 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 12.7 t-80 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 1.85 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.566 ' HA ' HG12 ' A' ' 502' ' ' VAL . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 2.63 109.728 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.52 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 1.051 ' HA ' HG22 ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.09 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 499' ' ' GLN . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.11 109.483 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 2.54 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 1.051 HG22 ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 1.75 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.19 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 2.7 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.569 ' HB ' HD12 ' A' ' 464' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 1.5 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.741 HG21 ' HG ' ' A' ' 485' ' ' LEU . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 2.72 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.443 ' HG2' ' HG3' ' A' ' 482' ' ' MET . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.37 110.185 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 1.63 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 1.59 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 1.65 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.9 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 2.97 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.1 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 5.5 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.32 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.937 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.47 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.63 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.937 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 2.98 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.9 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.3 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.14 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 2.93 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.467 HD23 HD12 ' A' ' 484' ' ' LEU . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 2.73 111.237 -176.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.443 ' HG3' ' HG2' ' A' ' 465' ' ' ARG . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 4.93 109.007 173.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.46 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.28 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.741 ' HG ' HG21 ' A' ' 464' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.19 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.86 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.27 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.28 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.47 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 0.96 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.608 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.22 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.38 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.607 ' HB2' HG21 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.737 HD23 HD12 ' A' ' 485' ' ' LEU . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 1.77 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 0.68 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.476 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 1.82 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.521 ' O ' HG23 ' A' ' 502' ' ' VAL . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 1.85 109.288 176.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 2.63 109.904 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.52 110.109 174.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.731 ' HA ' HG22 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.09 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 498' ' ' HIS . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.11 109.663 175.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 2.54 111.214 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 1.75 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.636 HG23 HG23 ' A' ' 504' ' ' ILE . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.19 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 2.7 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 1.5 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.523 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 2.72 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.37 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . 0.494 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 1.63 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 1.59 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 1.65 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 2.97 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.1 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 5.5 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.817 HD11 HD12 ' A' ' 505' ' ' ILE . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.32 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.709 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.47 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.63 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.409 ' HG2' ' OE1' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 2.98 112.029 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.3 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.14 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 2.93 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.69 HD12 HD11 ' A' ' 484' ' ' LEU . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 2.73 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.69 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 4.93 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.46 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.69 HD11 HD12 ' A' ' 481' ' ' LEU . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.28 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' A' ' 494' ' ' LEU . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.19 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . 0.531 ' N ' HD12 ' A' ' 485' ' ' LEU . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.86 111.825 175.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' A' ' 494' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.27 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.28 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.657 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 0.96 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.22 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.38 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' A' ' 485' ' ' LEU . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 1.77 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 0.68 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 2.98 110.671 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 1.82 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.565 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 1.85 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 2.63 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.52 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.09 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 498' ' ' HIS . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.11 109.599 173.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 2.54 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.633 HG22 HG23 ' A' ' 505' ' ' ILE . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 1.75 112.143 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.817 HD12 HD11 ' A' ' 473' ' ' LEU . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.19 112.298 -172.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 2.7 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 1.5 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.608 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 2.72 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.546 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.37 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 1.63 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 1.59 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.739 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 1.65 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.739 ' N ' HD12 ' A' ' 468' ' ' ILE . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 2.97 109.525 176.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.1 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 5.5 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.688 HD11 HG21 ' A' ' 505' ' ' ILE . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.32 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.718 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.47 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.714 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.754 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.63 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 2.98 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.718 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.3 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . 0.754 ' HE ' ' HA ' ' A' ' 476' ' ' ASP . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.14 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 2.93 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 2.73 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.546 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 4.93 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.46 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.407 ' O ' HG12 ' A' ' 488' ' ' ILE . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.28 111.615 178.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.19 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.86 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.27 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.28 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 0.96 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.22 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.38 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 1.77 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 0.68 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 2.98 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.573 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 1.82 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' ' 502' ' ' VAL . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 1.85 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 2.63 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.528 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.52 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 468' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.09 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 498' ' ' HIS . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.11 111.033 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 2.54 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 1.75 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.688 HG21 HD11 ' A' ' 473' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.19 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 2.7 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 1.5 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.505 HD13 ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 2.72 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.37 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 1.63 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 1.59 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.618 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 1.65 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 2.97 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.1 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.489 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.703 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.32 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.703 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.47 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.837 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.879 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.63 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.879 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 2.98 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.837 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.3 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.14 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.414 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 2.93 111.149 -177.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.598 HD23 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 2.73 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 4.93 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.46 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.28 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.724 HD13 HG13 ' A' ' 488' ' ' ILE . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.19 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.86 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.724 HG13 HD13 ' A' ' 485' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.27 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.28 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.426 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 0.96 111.561 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.22 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . 0.426 HD22 ' N ' ' A' ' 492' ' ' ASN . 0.1 OUTLIER -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.38 111.549 -179.211 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.447 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.694 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 1.77 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 0.68 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 2.98 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 1.82 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 464' ' ' ILE . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 1.85 108.927 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.578 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 2.63 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.561 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.52 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.09 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.433 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.11 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 2.54 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 1.75 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.19 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 2.7 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 1.5 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.474 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 2.72 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.37 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 1.63 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 1.59 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 1.65 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.784 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 2.97 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.1 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.47 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 5.5 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.424 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.32 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.47 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.677 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.63 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 2.98 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.784 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.3 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.14 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 2.93 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 2.73 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 486' ' ' ASP . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 4.93 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.46 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.28 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.6 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.19 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.86 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 489' ' ' LYS . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.27 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.766 ' HG2' HG22 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.28 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.476 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 0.96 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.698 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.22 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.38 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.44 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 491' ' ' ALA . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 1.77 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 0.68 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 2.98 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 1.82 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.54 ' O ' HG23 ' A' ' 502' ' ' VAL . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 1.85 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 2.63 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.506 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.52 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 504' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.09 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 498' ' ' HIS . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.11 109.942 174.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 2.54 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.651 HD12 HD13 ' A' ' 501' ' ' LEU . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 1.75 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.19 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . 0.455 ' HA ' ' HB3' ' A' ' 465' ' ' ARG . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 2.7 110.868 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 1.5 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.964 HD13 ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 2.72 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.455 ' HB3' ' HA ' ' A' ' 462' ' ' SER . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.37 110.361 173.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 1.63 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 1.59 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.532 HG22 HD12 ' A' ' 501' ' ' LEU . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 1.65 109.822 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 469' ' ' LYS . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 2.97 111.567 178.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.1 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.419 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 472' ' ' ARG . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 5.5 111.925 -173.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.627 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.32 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.946 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.47 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.885 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.63 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.946 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 2.98 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.885 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.3 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.14 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 2.93 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 484' ' ' LEU . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 2.73 111.734 -174.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.437 ' HG3' ' HD2' ' A' ' 469' ' ' LYS . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 4.93 109.15 175.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.46 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 481' ' ' LEU . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.28 111.347 174.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.797 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.19 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.86 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.797 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.27 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.28 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 0.96 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.22 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.38 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 1.77 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.563 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 0.68 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.562 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 2.98 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.562 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 1.82 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.964 ' HA ' HD13 ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 1.85 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 2.63 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.554 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.52 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 504' ' ' ILE . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.09 111.91 -172.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.11 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 2.54 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 501' ' ' LEU . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 1.75 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.19 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 2.7 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.5 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.493 HG12 ' HB2' ' A' ' 498' ' ' HIS . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 2.72 110.384 -175.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.37 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 1.63 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.636 HG13 ' CD2' ' A' ' 498' ' ' HIS . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 1.59 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.971 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 1.65 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.675 ' N ' HD12 ' A' ' 468' ' ' ILE . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 2.97 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.1 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . 0.617 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 5.5 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.817 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.32 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.817 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.47 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 1.065 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.63 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 2.98 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 1.065 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.3 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.14 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 2.93 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 2.73 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.488 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 4.93 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.46 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 488' ' ' ILE . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.28 111.107 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.968 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.19 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.86 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.968 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.27 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.28 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 0.96 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.22 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.38 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.745 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 1.77 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 0.68 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 2.98 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 1.82 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.636 ' CD2' HG13 ' A' ' 467' ' ' ILE . 31.8 t-80 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 1.85 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.631 ' HA ' HG12 ' A' ' 502' ' ' VAL . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 2.63 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.513 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.52 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 468' ' ' ILE . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.09 110.998 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.631 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.11 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 2.54 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 501' ' ' LEU . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 1.75 109.672 171.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.19 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 2.7 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 1.5 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 498' ' ' HIS . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 2.72 111.247 -175.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.438 ' HD3' ' HG3' ' A' ' 482' ' ' MET . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.37 110.28 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 1.63 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.559 HD12 HD13 ' A' ' 464' ' ' ILE . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 1.59 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.72 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 1.65 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.72 ' N ' HD12 ' A' ' 468' ' ' ILE . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 2.97 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.1 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 473' ' ' LEU . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 5.5 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 1.022 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.32 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 1.022 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.47 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.63 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 477' ' ' ARG . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 2.98 110.952 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.3 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.14 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.516 ' CZ ' HD11 ' A' ' 484' ' ' LEU . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 2.93 110.786 -179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 481' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 2.73 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.572 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 4.93 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.46 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.28 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.625 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.19 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.86 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.625 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.27 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.28 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 0.96 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.22 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.38 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . 0.5 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 1.77 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 0.68 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 2.98 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 1.82 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.632 ' HB2' HD11 ' A' ' 464' ' ' ILE . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 1.85 108.125 176.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 2.63 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.582 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.52 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.09 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.11 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 1.75 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.19 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 2.7 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 1.5 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.712 HD11 HD21 ' A' ' 501' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 2.72 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 1.037 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.37 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 1.63 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 1.59 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 1.65 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 468' ' ' ILE . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 2.97 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.1 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . 0.494 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 5.5 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.688 HD23 ' HB3' ' A' ' 478' ' ' LYS . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.32 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.562 ' OE1' HD12 ' A' ' 473' ' ' LEU . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.47 112.262 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.454 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.63 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 2.98 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HB3' HD23 ' A' ' 473' ' ' LEU . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.3 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.14 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 2.93 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 2.73 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 1.037 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 4.93 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.46 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.28 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.898 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.19 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.86 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.898 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.27 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 489' ' ' LYS . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.28 110.534 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 0.96 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.22 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.38 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.436 HD12 ' N ' ' A' ' 495' ' ' ALA . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 1.77 110.227 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.436 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 0.68 109.421 173.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 496' ' ' LYS . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 2.98 109.919 175.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 497' ' ' PHE . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 1.82 109.693 177.223 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 1.85 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.63 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.72 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.52 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.712 HD21 HD11 ' A' ' 464' ' ' ILE . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.09 112.258 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.454 ' N ' HD12 ' A' ' 501' ' ' LEU . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.11 110.516 178.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 2.54 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 1.75 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.19 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 2.7 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 1.5 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . 0.483 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 2.72 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.37 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 1.63 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 1.59 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ILE . . . . . 0.555 HD11 HD23 ' A' ' 485' ' ' LEU . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 1.65 110.656 -176.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 2.97 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.1 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' ARG . . . . . 0.504 ' HD3' ' HA ' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 5.5 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.32 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.763 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.47 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.738 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.63 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' ARG . . . . . 0.763 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 2.98 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.738 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.3 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.14 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' TYR . . . . . 0.502 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 2.93 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 2.73 110.991 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' MET . . . . . 0.621 ' HA ' HD23 ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 4.93 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.46 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.28 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.19 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.86 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.27 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.28 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . 0.469 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 0.96 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.22 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.38 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 1.77 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.623 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 0.68 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 2.98 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' PHE . . . . . 0.575 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 1.82 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' HIS . . . . . 0.623 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 1.85 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . 0.726 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 2.63 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' ' 497' ' ' PHE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.52 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.09 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.11 110.484 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.726 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 2.54 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 1.75 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.19 111.016 -178.226 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 111.846 0.313 . . . . 2.7 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.518 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.4 t -56.93 -58.4 5.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.346 0.593 . . . . 1.5 110.619 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.886 HG13 ' HB3' ' A' ' 494' ' ' LEU . 10.2 mm -66.83 -38.02 80.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.619 -0.719 . . . . 2.72 109.909 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.703 ' HG3' ' HG2' ' A' ' 482' ' ' MET . 51.3 ttp180 -57.78 -40.17 79.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 3.37 110.568 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 49.5 m -71.54 -44.68 64.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 1.63 111.179 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.697 HG21 ' CE1' ' A' ' 498' ' ' HIS . 40.3 mm -63.07 -46.77 95.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 C-N-CA 120.639 -0.424 . . . . 1.59 111.515 -176.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.649 HD13 HD12 ' A' ' 485' ' ' LEU . 13.0 pt -65.93 -35.89 76.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.163 -0.615 . . . . 1.65 110.499 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.702 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 35.2 ttpt -68.65 -27.41 65.97 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.07 0.462 . . . . 2.97 110.176 176.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.7 t -88.79 -7.57 55.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.933 -0.576 . . . . 2.1 110.208 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.562 ' HB3' HD21 ' A' ' 473' ' ' LEU . 48.8 m -74.9 99.3 3.77 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.161 0.505 . . . . 3.4 110.015 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -80.93 62.26 4.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.895 -0.593 . . . . 5.5 110.913 -174.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.652 HD12 ' HG2' ' A' ' 474' ' ' GLU . 0.3 OUTLIER -141.96 -56.48 0.46 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.567 -0.742 . . . . 2.32 110.848 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.652 ' HG2' HD12 ' A' ' 473' ' ' LEU . 35.0 mm-40 -94.07 108.22 20.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.351 -0.386 . . . . 3.47 110.023 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 8.8 tp10 -72.81 -81.36 0.06 Allowed 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.063 0.458 . . . . 2.79 110.664 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.551 ' HB2' ' NH2' ' A' ' 477' ' ' ARG . 13.0 m-20 -64.87 -27.29 68.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.333 -0.394 . . . . 2.63 110.369 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.604 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -70.71 -38.74 73.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 119.061 -0.495 . . . . 2.98 111.893 179.089 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 21.6 pttm -69.39 -34.3 74.31 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 119.197 0.908 . . . . 2.3 109.762 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -63.7 -48.79 75.69 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.448 0.642 . . . . 4.14 110.725 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.514 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 43.7 t80 -65.75 -47.75 74.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.411 -0.813 . . . . 2.93 110.529 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 20.6 tp -65.93 -23.52 66.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.986 -0.552 . . . . 2.73 110.403 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.703 ' HG2' ' HG3' ' A' ' 465' ' ' ARG . 15.3 tmm? -66.05 -53.65 35.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.737 -0.468 . . . . 4.93 109.737 175.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.495 HG22 ' O ' ' A' ' 480' ' ' TYR . 14.1 t -65.16 -21.88 66.84 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.681 -0.408 . . . . 2.46 110.609 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 71.2 mt -77.52 -58.49 3.24 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.486 -0.324 . . . . 2.28 111.423 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 468' ' ' ILE . 84.6 mt -67.46 -35.24 78.82 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.702 -0.226 . . . . 3.19 111.517 -174.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -59.64 -26.04 65.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 3.86 110.382 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -89.82 -16.95 29.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.839 -0.619 . . . . 2.77 110.414 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.66 ' HB ' HD21 ' A' ' 494' ' ' LEU . 45.0 mm -68.87 110.41 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 121.425 0.631 . . . . 2.27 109.827 175.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 489' ' ' LYS . 3.6 pttm -96.59 25.58 5.03 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.457 -0.792 . . . . 5.28 111.319 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.404 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -119.27 111.48 2.08 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 111.26 -0.736 . . . . 0.96 111.26 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.68 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.839 0.352 . . . . 1.22 111.296 -175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -65.39 -43.94 89.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.886 -0.597 . . . . 2.38 110.85 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -66.89 -37.57 84.65 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.13 -0.486 . . . . 1.97 110.397 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.886 ' HB3' HG13 ' A' ' 464' ' ' ILE . 40.7 mt -60.45 -47.45 86.04 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 1.77 110.916 175.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -58.59 -38.86 78.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.711 -0.677 . . . . 0.68 110.61 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -67.64 -40.34 84.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.086 -0.507 . . . . 2.98 110.902 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -64.82 -29.2 70.15 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.138 0.494 . . . . 1.82 110.732 176.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.79 ' HB2' HD12 ' A' ' 464' ' ' ILE . 0.9 OUTLIER -74.28 -53.45 9.71 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.024 -0.732 . . . . 1.85 109.024 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -53.24 -37.97 62.54 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.949 0.78 . . . . 2.63 109.253 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.571 ' O ' HG13 ' A' ' 504' ' ' ILE . 28.1 ttt -55.1 -69.17 0.14 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.743 -1.117 . . . . 2.52 111.138 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' A' ' 504' ' ' ILE . 3.5 pp -68.83 -30.3 68.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.52 0.563 . . . . 2.09 112.52 -173.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.476 ' N ' HD12 ' A' ' 501' ' ' LEU . 8.7 p -74.94 -25.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.063 -0.655 . . . . 1.11 110.248 -178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -84.24 -23.77 30.28 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.821 -0.351 . . . . 2.54 111.0 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 500' ' ' MET . 69.4 mt -61.02 -43.44 96.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.045 0.45 . . . . 1.75 110.38 173.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.488 HD11 HD13 ' A' ' 473' ' ' LEU . 44.0 mm . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.971 -0.558 . . . . 2.19 111.544 -178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.528 0.098 0 N-CA-C 112.021 0.378 . . . . 2.7 112.021 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 467' ' ' ILE . 47.9 t -58.46 -63.8 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.163 0.506 . . . . 1.5 110.891 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.916 HD13 ' HA ' ' A' ' 498' ' ' HIS . 7.4 tp -68.34 -29.03 42.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.223 -0.444 . . . . 2.72 110.869 -178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -65.23 -32.17 73.7 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.04 0.448 . . . . 3.37 110.633 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 54.5 m -78.81 -34.66 45.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.544 -0.298 . . . . 1.63 110.435 175.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.457 ' HB ' HD12 ' A' ' 464' ' ' ILE . 44.0 mm -62.56 -44.18 99.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.944 0 CA-C-O 121.096 0.474 . . . . 1.59 111.163 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 1.008 ' HB ' ' HB3' ' A' ' 478' ' ' LYS . 2.0 pp -64.67 -36.47 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 C-N-CA 118.818 -1.153 . . . . 1.65 110.125 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.601 ' N ' HD12 ' A' ' 468' ' ' ILE . 33.7 mtmm -70.41 -24.98 63.02 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 121.128 -0.229 . . . . 2.97 110.825 176.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.7 t -65.78 -23.98 66.83 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 109.028 -0.73 . . . . 2.1 109.028 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 33.6 t 68.23 -118.25 0.18 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.145 -0.934 . . . . 3.4 112.404 167.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 71.83 23.65 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.132 0.895 . . . . 5.5 110.716 -174.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 478' ' ' LYS . 0.6 OUTLIER -176.96 -164.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.252 -1.34 . . . . 2.32 107.945 170.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -56.99 119.02 5.57 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.563 0.696 . . . . 3.47 112.238 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -65.37 -24.72 67.31 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.179 -0.918 . . . . 2.79 109.567 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' A' ' 477' ' ' ARG . 6.4 m-20 -55.74 -45.05 78.1 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 120.781 0.324 . . . . 2.63 110.162 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.493 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -74.73 -27.41 60.36 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.53 -177.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 1.008 ' HB3' ' HB ' ' A' ' 468' ' ' ILE . 29.6 mmtp -72.99 -40.58 65.12 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 120.9 0.381 . . . . 2.3 110.272 176.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -68.96 -38.79 79.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.865 -0.607 . . . . 4.14 109.675 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 64.3 t80 -58.31 -53.71 55.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.452 -0.794 . . . . 2.93 109.853 175.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 485' ' ' LEU . 47.5 tp -61.87 -38.28 87.68 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 115.189 -0.914 . . . . 2.73 111.241 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 485' ' ' LEU . 57.9 ttp -69.24 -34.31 74.63 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 117.66 0.209 . . . . 4.93 110.505 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 90.6 m -62.49 -33.72 75.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.504 0.669 . . . . 2.46 109.424 173.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.494 ' O ' HG12 ' A' ' 488' ' ' ILE . 92.1 mt -77.23 -41.02 42.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.191 -0.913 . . . . 2.28 111.071 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' A' ' 488' ' ' ILE . 92.6 mt -60.77 -40.39 92.35 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.135 0.493 . . . . 3.19 110.29 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.37 -22.1 18.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.195 -0.911 . . . . 3.86 111.494 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -110.25 -8.77 14.7 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.209 -0.451 . . . . 2.77 111.14 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.819 HG22 ' H ' ' A' ' 490' ' ' GLY . 18.4 mm -58.44 144.72 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.003 0.43 . . . . 2.27 110.912 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.75 -4.09 22.06 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.773 -0.648 . . . . 5.28 112.726 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.819 ' H ' HG22 ' A' ' 488' ' ' ILE . . . 116.48 -143.75 18.17 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.134 -1.031 . . . . 0.96 114.421 171.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -32.85 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 115.041 1.497 . . . . 1.22 115.041 -167.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -54.33 -43.48 71.24 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.798 0.666 . . . . 2.38 112.798 -170.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -68.94 -51.43 39.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.312 -0.403 . . . . 1.97 111.044 -172.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 4.3 pp -71.29 -23.69 62.01 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.641 -0.424 . . . . 1.77 110.897 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.467 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -68.04 -42.13 81.03 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.019 0.438 . . . . 0.68 110.053 176.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 500' ' ' MET . 28.8 tptp -68.82 -37.8 79.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.061 -0.518 . . . . 2.98 110.259 177.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -69.08 -28.98 67.0 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.248 0.547 . . . . 1.82 110.926 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.916 ' HA ' HD13 ' A' ' 464' ' ' ILE . 30.9 t-80 -69.62 -55.83 8.96 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.1 -0.704 . . . . 1.85 109.1 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.651 ' HA ' HG12 ' A' ' 502' ' ' VAL . 25.0 tt0 -61.63 -29.04 69.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.137 -0.938 . . . . 2.63 109.627 176.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.444 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 27.3 ttt -58.69 -60.03 4.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.054 -0.521 . . . . 2.52 110.978 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.757 ' HA ' HG22 ' A' ' 504' ' ' ILE . 7.5 mp -79.73 -30.69 40.94 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.43 -0.508 . . . . 2.09 112.218 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.651 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -68.04 -25.66 32.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 119.44 -0.904 . . . . 1.11 109.262 177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 499' ' ' GLN . 15.0 ttmm -84.26 -31.2 25.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.015 -0.538 . . . . 2.54 111.023 173.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' A' ' 501' ' ' LEU . 7.1 tp -74.85 -18.39 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.0 0.429 . . . . 1.75 110.877 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 2.19 110.049 175.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.548 0.213 . . . . 2.7 111.191 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 467' ' ' ILE . 66.1 t -61.3 -57.57 11.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-O 120.776 0.322 . . . . 1.5 110.223 178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.664 HG12 ' HB2' ' A' ' 498' ' ' HIS . 83.3 mt -55.91 -48.28 78.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.554 -0.748 . . . . 2.72 111.215 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.448 ' HD2' ' OD1' ' A' ' 486' ' ' ASP . 53.1 ttt180 -54.02 -47.45 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 3.37 111.052 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 36.7 t -66.46 -36.1 81.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.463 -0.335 . . . . 1.63 110.388 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.84 -59.26 3.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.354 -0.384 . . . . 1.59 111.771 -177.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.569 HD13 ' O ' ' A' ' 464' ' ' ILE . 0.1 OUTLIER -63.65 -41.46 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.186 -1.006 . . . . 1.65 110.581 -176.279 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.521 ' N ' HG12 ' A' ' 468' ' ' ILE . 30.7 mtpp -55.41 -39.7 70.54 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.732 -0.213 . . . . 2.97 111.031 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 58.7 p -88.19 -17.47 30.81 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.906 0.336 . . . . 2.1 111.906 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 24.7 m -95.86 114.11 25.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.4 110.842 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . 0.735 ' HD3' ' H ' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -92.53 84.37 5.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.353 0.597 . . . . 5.5 111.348 -176.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.816 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.8 pt? -141.06 -16.41 0.85 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.103 -0.499 . . . . 2.32 111.824 175.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.816 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 35.5 mm-40 -120.04 -9.5 9.6 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 113.415 0.894 . . . . 3.47 113.415 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.702 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 38.4 mt-10 42.7 -99.37 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.704 1.001 . . . . 2.79 113.704 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -70.49 -28.32 64.89 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 121.99 -0.444 . . . . 2.63 109.86 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.681 ' HA ' ' HB3' ' A' ' 480' ' ' TYR . 0.0 OUTLIER -75.85 -26.35 57.06 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.084 -0.507 . . . . 2.98 110.527 172.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 475' ' ' GLU . 21.9 mtpp -55.1 -50.38 69.33 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.52 -0.918 . . . . 2.3 108.52 168.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -71.87 -38.72 69.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.977 -1.01 . . . . 4.14 111.341 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 477' ' ' ARG . 41.7 t80 -68.66 -54.98 13.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.078 -0.51 . . . . 2.93 111.096 -177.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 22.4 tp -58.51 -35.32 72.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.333 -0.394 . . . . 2.73 110.04 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 42.5 ttp -58.2 -48.46 80.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.975 0.417 . . . . 4.93 109.933 173.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 50.4 m -61.54 -30.13 70.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.747 -0.66 . . . . 2.46 111.059 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 97.5 mt -79.2 -64.38 1.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.785 -0.643 . . . . 2.28 111.482 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.844 ' HA ' HG12 ' A' ' 488' ' ' ILE . 81.3 mt -65.09 -35.87 82.51 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.074 0.398 . . . . 3.19 112.074 -171.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . 0.448 ' OD1' ' HD2' ' A' ' 465' ' ' ARG . 29.6 t70 -68.74 -6.14 24.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.61 0.719 . . . . 3.86 110.596 178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -114.93 -11.85 12.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.942 -0.572 . . . . 2.77 110.446 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.844 HG12 ' HA ' ' A' ' 485' ' ' LEU . 26.8 mm -60.31 126.93 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.134 0.492 . . . . 2.27 110.85 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -107.39 13.58 26.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.857 -0.61 . . . . 5.28 111.205 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.596 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -109.71 104.49 1.88 Allowed Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 111.27 -0.732 . . . . 0.96 111.27 176.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.474 ' HA ' HD11 ' A' ' 494' ' ' LEU . . . -61.17 -36.94 81.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.268 0.47 . . . . 1.22 112.268 -172.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -61.49 -50.09 74.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.521 0.677 . . . . 2.38 109.864 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.58 -55.51 23.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.542 -1.208 . . . . 1.97 111.439 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.729 HD12 ' N ' ' A' ' 495' ' ' ALA . 1.9 pp -59.81 -43.51 94.46 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.774 0.287 . . . . 1.77 111.774 -175.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.729 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -63.35 -33.22 75.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.68 109.823 179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.7 tmmm? -73.51 -34.65 65.38 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.901 -0.591 . . . . 2.98 110.257 177.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 500' ' ' MET . 39.5 m-85 -67.83 -24.18 65.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.412 0.625 . . . . 1.82 110.193 174.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.664 ' HB2' HG12 ' A' ' 464' ' ' ILE . 11.3 t-160 -74.36 -45.21 48.51 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.385 -0.969 . . . . 1.85 108.385 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 52.9 mt-30 -57.4 -32.12 66.53 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.705 -0.679 . . . . 2.63 109.566 172.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 17.1 tmm? -63.44 -47.26 82.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.52 -0.764 . . . . 2.52 110.445 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.737 ' HA ' HG22 ' A' ' 504' ' ' ILE . 15.5 mt -70.72 -29.82 66.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.928 0.394 . . . . 2.09 110.073 177.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 498' ' ' HIS . 82.5 t -64.28 -28.25 44.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 CA-C-O 121.331 0.586 . . . . 1.11 109.661 173.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.6 mttp -83.43 -29.26 28.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.389 -0.369 . . . . 2.54 111.151 175.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.737 HG22 ' HA ' ' A' ' 501' ' ' LEU . 10.6 tp -75.68 -40.24 40.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 120.532 -0.467 . . . . 1.75 111.849 -177.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.693 HG23 HG23 ' A' ' 504' ' ' ILE . 41.4 pt . . . . . 0 N--CA 1.464 0.257 0 O-C-N 122.07 -0.394 . . . . 2.19 111.541 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.457 -0.108 0 N-CA-C 113.437 0.903 . . . . 2.7 113.437 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 467' ' ' ILE . 47.9 t -54.96 -70.11 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 120.909 0.385 . . . . 1.5 111.36 -175.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.608 HD11 ' HB2' ' A' ' 498' ' ' HIS . 50.7 mm -69.08 -34.21 62.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.467 -0.333 . . . . 2.72 110.806 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 24.2 ttt180 -64.44 -35.94 82.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.843 0.354 . . . . 3.37 110.77 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 40.7 t -72.32 -44.13 63.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.267 -0.424 . . . . 1.63 109.898 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 463' ' ' VAL . 79.4 mt -59.35 -56.02 19.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.265 -0.425 . . . . 1.59 111.428 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.919 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.7 pp -63.87 -37.1 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 C-N-CA 119.804 -0.758 . . . . 1.65 111.443 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.687 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 tttp -60.32 -36.68 78.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.802 0.334 . . . . 2.97 110.536 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 25.1 p -94.35 -3.05 51.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.271 -0.422 . . . . 2.1 111.796 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 73.2 m -61.22 142.85 56.49 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.131 0.491 . . . . 3.4 111.072 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -87.55 -20.12 26.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.132 -176.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.53 HD13 HD13 ' A' ' 505' ' ' ILE . 1.9 pt? -103.89 163.89 12.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.445 -0.343 . . . . 2.32 111.198 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 33.7 mt-10 28.08 75.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.852 1.345 . . . . 3.47 113.375 172.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 39.5 mt-10 -76.33 -21.99 55.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.582 0.586 . . . . 2.79 112.582 -174.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.514 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 24.3 m-20 -75.24 -29.75 60.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 119.478 -0.889 . . . . 2.63 109.252 172.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -61.78 -44.34 97.06 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 109.485 -0.561 . . . . 2.98 109.485 171.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.919 ' HB2' ' HB ' ' A' ' 468' ' ' ILE . 25.5 pttt -65.58 -40.13 92.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.486 -0.325 . . . . 2.3 110.453 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . 0.514 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 98.3 mtt180 -61.6 -53.78 51.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 4.14 109.933 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -58.94 -46.27 88.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.541 -0.754 . . . . 2.93 110.41 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.703 HD13 HG21 ' A' ' 468' ' ' ILE . 4.4 tt -59.62 -51.92 67.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.217 -0.902 . . . . 2.73 110.974 -176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.639 ' HB3' HD11 ' A' ' 468' ' ' ILE . 26.9 ptt? -66.37 -27.39 67.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.568 -0.453 . . . . 4.93 111.146 -178.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 60.3 m -67.63 -39.28 84.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.185 0.517 . . . . 2.46 110.681 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 481' ' ' LEU . 4.3 pp -83.79 -33.41 24.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.173 0.511 . . . . 2.28 110.779 176.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.721 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 32.1 tp -62.13 -39.58 93.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.606 -0.724 . . . . 3.19 111.281 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.14 -29.91 33.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 3.86 110.926 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.44 -23.4 22.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.617 -0.72 . . . . 2.77 110.929 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.721 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 8.4 mm -50.52 143.86 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 112.632 0.605 . . . . 2.27 112.632 -179.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HD3' ' C ' ' A' ' 489' ' ' LYS . 0.8 OUTLIER -55.85 -61.7 2.19 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.18 0.3 . . . . 5.28 111.432 -174.511 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.45 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 177.09 -133.56 2.28 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 119.108 -1.52 . . . . 0.96 114.892 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -59.25 -43.6 92.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.853 1.056 . . . . 1.22 113.853 -166.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -57.28 -47.25 81.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.781 0.324 . . . . 2.38 111.106 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.45 -40.02 89.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.148 -0.478 . . . . 1.97 110.313 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.583 HD23 HD11 ' A' ' 485' ' ' LEU . 96.8 mt -56.25 -55.42 33.5 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.083 -0.508 . . . . 1.77 110.886 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.71 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 0.68 110.421 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 500' ' ' MET . 0.9 OUTLIER -64.16 -52.26 59.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.635 -0.711 . . . . 2.98 110.298 178.442 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -67.53 -21.88 65.45 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.942 0.401 . . . . 1.82 111.088 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.608 ' HB2' HD11 ' A' ' 464' ' ' ILE . 13.8 t-80 -73.98 -52.14 13.73 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.013 -0.736 . . . . 1.85 109.013 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -53.69 -35.44 61.1 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.663 -0.699 . . . . 2.63 109.478 173.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.646 ' O ' HG12 ' A' ' 504' ' ' ILE . 19.2 mmt -64.98 -63.12 1.19 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.457 -0.792 . . . . 2.52 112.357 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 502' ' ' VAL . 3.9 pp -64.64 -26.88 68.58 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 121.651 -0.656 . . . . 2.09 111.486 -176.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.414 ' N ' HD12 ' A' ' 501' ' ' LEU . 55.9 t -69.98 -39.3 77.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 121.199 -0.2 . . . . 1.11 110.633 176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 500' ' ' MET . 0.0 OUTLIER -76.41 -19.92 57.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.25 176.57 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.831 HG22 HG23 ' A' ' 505' ' ' ILE . 33.5 mm -69.09 -60.31 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.346 -0.388 . . . . 1.75 111.219 177.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.831 HG23 HG22 ' A' ' 504' ' ' ILE . 40.7 pt . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 112.777 0.658 . . . . 2.19 112.777 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 112.608 0.596 . . . . 2.7 112.608 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 55.3 t -58.82 -65.3 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.915 0.388 . . . . 1.5 110.433 -179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 485' ' ' LEU . 6.4 tt -65.33 -42.06 92.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.813 -0.355 . . . . 2.72 110.861 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 21.8 ttt-85 -59.89 -49.37 77.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.439 -0.346 . . . . 3.37 111.186 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 44.7 t -73.03 -46.38 52.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.241 -0.436 . . . . 1.63 110.889 -177.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.71 -46.28 95.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 N-CA-C 111.922 0.342 . . . . 1.59 111.922 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 15.3 pt -66.32 -41.93 89.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 C-N-CA 119.173 -1.011 . . . . 1.65 109.944 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -59.48 -32.37 70.2 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.911 0.386 . . . . 2.97 110.92 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 50.5 m -79.36 -18.71 51.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.314 -0.403 . . . . 2.1 111.354 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 39.6 t -55.59 112.05 1.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.995 0.426 . . . . 3.4 110.592 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -82.61 -23.73 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.499 -0.319 . . . . 5.5 110.955 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -77.13 -50.31 13.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.148 0.499 . . . . 2.32 110.801 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.608 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 7.6 mm-40 -87.97 75.25 8.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 3.47 110.662 -174.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 45.3 mt-10 -59.99 -72.14 0.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.078 0.466 . . . . 2.79 111.057 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.45 ' HA ' ' HD2' ' A' ' 479' ' ' ARG . 74.2 m-20 -71.83 -23.44 61.54 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.483 -0.326 . . . . 2.63 110.917 -176.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.608 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.1 OUTLIER -64.48 -56.74 12.14 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 116.466 -0.334 . . . . 2.98 110.493 176.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 61.2 pttt -59.45 -38.99 82.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 120.651 -0.419 . . . . 2.3 110.847 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 476' ' ' ASP . 83.6 mtt180 -58.16 -52.43 65.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 4.14 110.604 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -62.09 -50.85 70.29 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.788 -0.642 . . . . 2.93 110.76 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 497' ' ' PHE . 34.8 tp -65.17 -31.13 72.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.063 -0.517 . . . . 2.73 111.816 -176.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.54 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 49.4 ttp -80.52 -32.74 36.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.582 0.229 . . . . 4.93 110.388 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 89.2 m -62.23 -35.59 79.37 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.49 0.662 . . . . 2.46 109.245 173.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 488' ' ' ILE . 90.1 mt -75.66 -45.34 37.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.228 -0.897 . . . . 2.28 110.582 173.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 482' ' ' MET . 53.3 tp -58.77 -40.46 84.01 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 112.04 0.385 . . . . 3.19 112.04 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -60.05 -18.42 46.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.836 0.35 . . . . 3.86 111.064 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -114.07 -5.99 13.1 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.508 -0.314 . . . . 2.77 110.954 177.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 11.7 mt -57.09 133.91 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.054 0.454 . . . . 2.27 110.593 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 33.2 mttm -111.68 -23.05 10.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.509 -0.769 . . . . 5.28 110.858 -171.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -99.48 127.32 9.21 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.918 -0.658 . . . . 0.96 112.445 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.42 ' HA ' HD21 ' A' ' 494' ' ' LEU . . . -63.9 -33.9 76.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.789 0.328 . . . . 1.22 110.447 176.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -67.23 -37.82 84.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 2.38 110.669 176.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -59.72 -60.02 4.51 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 120.9 0.381 . . . . 1.97 110.82 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 488' ' ' ILE . 2.7 pp -60.82 -39.64 89.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.743 -0.662 . . . . 1.77 111.598 -175.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -63.02 -40.36 97.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.898 0.38 . . . . 0.68 110.374 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 496' ' ' LYS . 36.3 mmtt -70.54 -40.82 73.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 2.98 111.882 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HB3' HD11 ' A' ' 481' ' ' LEU . 23.1 m-85 -68.9 -29.52 67.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.389 0.614 . . . . 1.82 110.686 178.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 502' ' ' VAL . 77.3 t60 -70.64 -57.17 4.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.5 -0.773 . . . . 1.85 109.752 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 10.3 pt20 -64.13 -20.32 65.9 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.005 -0.543 . . . . 2.63 110.1 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.545 ' O ' HG12 ' A' ' 504' ' ' ILE . 49.7 tpp -60.36 -57.1 14.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.752 -0.462 . . . . 2.52 109.752 176.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.53 -31.65 72.83 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.344 -0.389 . . . . 2.09 110.834 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 498' ' ' HIS . 86.2 t -60.76 -43.42 95.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 120.814 -0.354 . . . . 1.11 110.262 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -73.09 -24.96 60.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 2.54 110.697 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 500' ' ' MET . 33.0 mm -62.02 -44.96 99.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.666 -0.494 . . . . 1.75 109.666 172.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.679 -0.692 . . . . 2.19 110.258 174.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.053 0.39 . . . . 2.7 112.053 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.79 -69.84 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 120.864 0.364 . . . . 1.5 110.789 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.661 HG23 HD11 ' A' ' 485' ' ' LEU . 4.3 tt -62.63 -33.52 60.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.289 -0.414 . . . . 2.72 110.808 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 465' ' ' ARG . 11.7 ttm180 -54.24 -54.83 34.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.117 0.484 . . . . 3.37 110.74 177.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 14.8 m -67.84 -43.7 78.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.75 -0.659 . . . . 1.63 110.756 -177.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 72.4 mt -60.36 -52.05 65.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.309 0.485 . . . . 1.59 112.309 -174.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . 12.2 pt -65.16 -41.69 92.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.876 -0.73 . . . . 1.65 111.081 -175.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 11.5 ptmm? -64.39 -36.42 84.1 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.136 0.493 . . . . 2.97 110.345 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 59.9 m -75.06 -19.59 59.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.563 -0.744 . . . . 2.1 111.21 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 67.1 m -73.43 121.11 19.99 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.149 0.5 . . . . 3.4 110.065 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -114.1 78.84 1.18 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.795 -0.639 . . . . 5.5 110.821 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 1.3 pt? -138.96 -52.76 0.57 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.453 -0.794 . . . . 2.32 109.492 174.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.771 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.7 pt-20 -120.01 91.51 3.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.404 0.621 . . . . 3.47 109.679 174.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 478' ' ' LYS . 6.9 mm-40 -62.53 -45.86 91.03 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.049 -0.978 . . . . 2.79 111.514 -172.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -66.65 -37.38 84.69 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.258 -0.577 . . . . 2.63 110.261 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.01 -48.55 78.31 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 112.047 0.388 . . . . 2.98 112.047 178.136 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.749 ' HD3' ' HA ' ' A' ' 469' ' ' LYS . 0.0 OUTLIER -68.1 -37.44 81.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.693 -0.403 . . . . 2.3 111.264 -177.029 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.26 -43.76 90.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.839 0.352 . . . . 4.14 110.434 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.98 -49.93 75.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.905 -0.589 . . . . 2.93 110.779 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 40.6 tp -72.57 -23.33 60.95 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.931 -0.577 . . . . 2.73 111.638 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.602 ' HA ' ' HB3' ' A' ' 485' ' ' LEU . 46.6 ttp -84.19 -26.88 28.44 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.705 -0.398 . . . . 4.93 110.052 176.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.4 m -67.66 -34.76 77.59 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.772 -0.825 . . . . 2.46 108.772 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 488' ' ' ILE . 77.0 mt -75.1 -38.54 61.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.201 -0.909 . . . . 2.28 110.474 173.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.661 HD11 HG23 ' A' ' 464' ' ' ILE . 6.7 tt -60.7 -38.33 84.65 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.549 -0.296 . . . . 3.19 110.893 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -54.35 -31.21 53.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.338 0.59 . . . . 3.86 110.567 173.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -90.52 -19.1 24.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.754 -0.657 . . . . 2.77 110.852 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.827 HG21 ' HB3' ' A' ' 494' ' ' LEU . 53.6 mt -64.21 106.39 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.389 0.614 . . . . 2.27 111.118 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 49.2 pttt -104.94 23.85 12.87 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.927 -1.033 . . . . 5.28 110.391 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -129.57 117.48 2.38 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.78 -0.646 . . . . 0.96 111.851 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -64.24 -42.05 96.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.841 0.353 . . . . 1.22 111.472 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -70.96 -33.7 70.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.11 0.481 . . . . 2.38 110.222 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.27 -53.71 44.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.493 -0.776 . . . . 1.97 111.112 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.827 ' HB3' HG21 ' A' ' 488' ' ' ILE . 4.1 pp -66.26 -26.79 67.51 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 1.77 110.698 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.446 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -65.27 -39.47 92.64 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.824 -0.436 . . . . 0.68 109.824 175.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.409 ' HD2' ' C ' ' A' ' 496' ' ' LYS . 2.2 tmmm? -62.87 -52.82 61.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.707 -0.679 . . . . 2.98 109.68 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -60.63 -28.82 68.84 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.138 0.494 . . . . 1.82 111.294 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.527 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.8 t-80 -69.09 -59.16 3.22 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.712 -0.676 . . . . 1.85 109.627 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 42.3 tp60 -60.82 -27.67 68.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.528 -0.76 . . . . 2.63 109.42 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.1 ttt -59.34 -61.19 2.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.38 -0.827 . . . . 2.52 110.619 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 505' ' ' ILE . 79.0 mt -67.59 -28.26 67.61 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.629 -0.428 . . . . 2.09 110.803 -178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 498' ' ' HIS . 68.6 t -58.94 -44.11 90.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.912 0.387 . . . . 1.11 110.094 173.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.3 mtpt -69.07 -29.13 67.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 2.54 110.736 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.1 -41.88 90.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 120.732 0.301 . . . . 1.75 110.595 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 501' ' ' LEU . 50.4 mm . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.152 0.501 . . . . 2.19 110.887 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.234 0.275 0 N-CA-C 112.312 0.486 . . . . 2.7 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.86 -43.47 74.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.713 -0.676 . . . . 1.5 111.155 -177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.61 ' H ' HD12 ' A' ' 464' ' ' ILE . 3.7 mp -68.27 -55.89 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.077 -0.511 . . . . 2.72 110.459 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 39.1 ttm105 -54.05 -42.61 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.728 -0.669 . . . . 3.37 111.281 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 3.7 t -70.06 -49.46 50.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.112 -0.495 . . . . 1.63 110.502 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 51.0 mt -64.76 -43.87 96.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 112.413 0.523 . . . . 1.59 112.413 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.517 HG23 ' O ' ' A' ' 464' ' ' ILE . 7.4 pt -61.58 -44.12 98.11 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 119.688 -0.805 . . . . 1.65 109.881 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.759 ' HA ' ' HB2' ' A' ' 478' ' ' LYS . 40.6 pttt -71.44 -22.58 61.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.27 0.557 . . . . 2.97 110.117 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 49.2 m -91.42 -0.25 57.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.634 -0.712 . . . . 2.1 112.286 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.422 ' HB2' HD21 ' A' ' 473' ' ' LEU . 89.1 p -61.9 102.77 0.3 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.583 0.706 . . . . 3.4 109.985 173.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 65.2 mtm180 -83.49 58.73 4.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.221 0.534 . . . . 5.5 111.612 -175.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.676 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -145.53 -54.53 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.73 -0.668 . . . . 2.32 110.997 176.539 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.676 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.9 pt-20 -111.63 95.74 5.67 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.074 0.464 . . . . 3.47 111.229 -176.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.978 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 8.7 pt-20 -67.94 -41.05 83.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.93 -0.577 . . . . 2.79 111.056 -175.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -66.56 -45.46 79.25 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 120.573 -0.451 . . . . 2.63 110.386 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.484 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 3.0 mtm180 -64.8 -41.51 95.75 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.572 0.582 . . . . 2.98 112.572 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.978 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 22.3 pttp -65.26 -40.17 93.59 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 119.867 -0.733 . . . . 2.3 111.424 178.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -64.5 -50.91 65.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.217 0.532 . . . . 4.14 110.786 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -60.67 -55.01 38.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.036 -0.984 . . . . 2.93 111.035 -176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 42.3 tp -64.89 -36.04 83.09 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.657 -0.702 . . . . 2.73 111.595 -175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 46.6 ttp -66.21 -44.13 84.77 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.992 -0.373 . . . . 4.93 109.992 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 30.0 m -58.51 -37.67 76.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.287 0.565 . . . . 2.46 110.181 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.54 ' O ' HG13 ' A' ' 488' ' ' ILE . 75.7 mt -78.29 -37.13 45.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.633 -0.712 . . . . 2.28 111.387 177.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.501 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 5.8 tt -72.13 -36.16 69.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.555 -0.293 . . . . 3.19 111.298 -173.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.95 -19.57 52.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.204 0.526 . . . . 3.86 110.618 171.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -96.19 -18.11 20.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.934 -0.575 . . . . 2.77 110.259 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 484' ' ' LEU . 68.3 mt -72.66 112.33 8.4 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 N-CA-C 109.619 -0.511 . . . . 2.27 109.619 176.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 65.2 tttt -109.35 98.5 7.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.037 -0.529 . . . . 5.28 110.197 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.461 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . 163.35 119.65 0.49 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.555 -0.618 . . . . 0.96 111.555 -177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.39 -40.07 89.58 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.946 0.35 . . . . 1.22 111.946 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -67.35 -37.57 83.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.332 0.587 . . . . 2.38 109.903 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.472 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 5.4 m-20 -67.95 -47.45 68.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.201 -0.909 . . . . 1.97 110.565 -177.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 81.0 mt -58.03 -51.87 67.88 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.148 -0.478 . . . . 1.77 110.725 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 499' ' ' GLN . . . -57.55 -38.63 75.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.68 110.606 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -64.08 -44.91 90.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.508 -0.769 . . . . 2.98 110.678 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 40.4 m-85 -65.74 -28.36 68.98 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.235 0.54 . . . . 1.82 111.062 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.533 ' HB2' HG13 ' A' ' 464' ' ' ILE . 22.6 t-80 -68.47 -54.07 19.34 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.402 -0.592 . . . . 1.85 109.402 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 495' ' ' ALA . 16.8 mm100 -66.23 -20.05 66.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.451 -0.795 . . . . 2.63 109.629 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -63.16 -51.77 65.08 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.716 -0.674 . . . . 2.52 109.547 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.55 ' HA ' HG22 ' A' ' 504' ' ' ILE . 84.5 mt -69.35 -30.27 68.26 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.416 -0.514 . . . . 2.09 110.428 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 498' ' ' HIS . 73.5 t -59.78 -33.31 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.938 -0.393 . . . . 1.11 109.938 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 58.4 mtpt -83.96 -29.87 26.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.372 -0.377 . . . . 2.54 111.299 177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.55 HG22 ' HA ' ' A' ' 501' ' ' LEU . 6.4 tp -73.48 -29.53 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.893 0.377 . . . . 1.75 110.663 -178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 2.19 110.192 178.541 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.632 0.253 . . . . 2.7 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.616 ' O ' HG12 ' A' ' 467' ' ' ILE . 99.5 t -56.95 -58.02 7.44 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 CA-C-N 116.167 -0.47 . . . . 1.5 110.364 175.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 498' ' ' HIS . 43.2 mm -60.89 -41.57 89.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 120.905 0.383 . . . . 2.72 110.642 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -56.33 -39.97 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 3.37 110.695 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 13.4 m -78.1 -36.27 48.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.033 -0.53 . . . . 1.63 110.745 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 463' ' ' VAL . 29.7 mm -58.44 -53.81 41.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.196 -0.456 . . . . 1.59 111.427 -178.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.644 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.1 pp -64.02 -43.48 97.59 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 C-N-CA 119.482 -0.887 . . . . 1.65 111.145 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.644 ' N ' HD12 ' A' ' 468' ' ' ILE . 64.1 mttm -57.54 -36.1 71.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.685 0.279 . . . . 2.97 111.136 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 42.1 p -92.13 -12.06 33.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.78 0.289 . . . . 2.1 111.78 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 77.3 p -69.87 159.96 32.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.813 0.339 . . . . 3.4 110.659 -178.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -112.97 55.87 0.69 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.201 -0.454 . . . . 5.5 110.504 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.28 -73.47 0.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.667 0.746 . . . . 2.32 110.056 -178.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.874 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 1.3 tm-20 -165.55 139.99 4.78 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.421 -1.326 . . . . 3.47 107.421 -173.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.808 ' HG2' ' HD2' ' A' ' 478' ' ' LYS . 4.2 tm-20 -85.03 -35.49 21.88 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 120.59 -0.444 . . . . 2.79 111.779 -169.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -65.65 -39.56 91.53 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.276 -1.009 . . . . 2.63 108.276 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.874 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -57.85 -41.58 82.66 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.208 -0.906 . . . . 2.98 111.043 172.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.808 ' HD2' ' HG2' ' A' ' 475' ' ' GLU . 95.5 mttt -51.83 -57.64 8.75 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.945 0.403 . . . . 2.3 110.278 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -65.2 -36.59 84.64 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 4.14 111.606 -179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -60.67 -56.81 16.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.385 0.612 . . . . 2.93 110.666 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.435 ' O ' HD23 ' A' ' 485' ' ' LEU . 94.8 mt -65.63 -35.23 80.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.511 -0.768 . . . . 2.73 110.702 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 52.9 ttp -58.31 -49.46 77.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.006 0.431 . . . . 4.93 110.277 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 37.0 m -64.3 -33.91 76.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.733 -0.667 . . . . 2.46 111.164 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 90.7 mt -76.85 -55.11 5.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 2.28 111.855 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.682 HD13 HD12 ' A' ' 488' ' ' ILE . 4.0 mm? -69.48 -44.24 71.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.368 -0.378 . . . . 3.19 111.751 -172.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -63.99 -25.25 68.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.537 0.684 . . . . 3.86 109.454 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.52 -24.78 49.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.491 -0.777 . . . . 2.77 110.661 175.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.716 ' HB ' HD21 ' A' ' 494' ' ' LEU . 9.5 mt -57.59 -48.71 82.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.168 0.508 . . . . 2.27 110.635 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 63.69 14.55 8.27 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.135 -0.939 . . . . 5.28 113.187 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.482 ' H ' HG22 ' A' ' 488' ' ' ILE . . . -98.9 111.48 4.24 Favored Glycine 0 N--CA 1.45 -0.371 0 N-CA-C 110.983 -0.847 . . . . 0.96 110.983 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -55.04 -52.82 61.98 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.501 0.556 . . . . 1.22 112.501 -171.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.35 -45.29 84.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.374 -0.375 . . . . 2.38 111.51 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 496' ' ' LYS . 10.6 m-20 -70.64 -28.76 65.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.478 -0.328 . . . . 1.97 111.317 -177.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.716 HD21 ' HB ' ' A' ' 488' ' ' ILE . 80.0 mt -72.42 -31.37 65.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.872 0.367 . . . . 1.77 110.284 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.02 75.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.126 -0.694 . . . . 0.68 109.126 172.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 493' ' ' ASP . 22.7 tptm -61.14 -51.83 67.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.982 -1.008 . . . . 2.98 110.669 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 55.4 m-85 -68.23 -22.36 64.79 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.972 0.415 . . . . 1.82 110.872 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.4 t-160 -69.69 -54.31 14.44 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.021 -0.733 . . . . 1.85 109.021 175.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -59.32 -30.17 68.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 2.63 109.838 175.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.466 ' O ' HG13 ' A' ' 504' ' ' ILE . 27.4 ttt -63.02 -50.77 69.36 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.758 -0.655 . . . . 2.52 110.605 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 504' ' ' ILE . 59.2 mt -63.13 -34.9 78.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.793 0.33 . . . . 2.09 110.275 178.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.3 t -63.17 -36.35 75.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 1.11 110.226 175.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.71 -15.96 57.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.449 -0.341 . . . . 2.54 110.961 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.609 HD12 HD23 ' A' ' 501' ' ' LEU . 60.3 mt -72.31 -43.69 64.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.785 0.326 . . . . 1.75 110.713 173.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.361 . . . . 2.19 111.645 -179.261 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.441 -0.913 0 CA-C-O 121.913 0.863 . . . . 2.7 113.128 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 42.9 t -51.57 -41.58 27.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.949 -1.478 . . . . 1.5 111.838 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 465' ' ' ARG . 7.8 tp -60.66 -53.17 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.963 -0.295 . . . . 2.72 111.432 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.64 ' HB2' ' OD1' ' A' ' 486' ' ' ASP . 15.2 ttt180 -74.12 -26.01 60.1 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.647 -0.421 . . . . 3.37 111.261 -175.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 70.8 p -75.16 -50.51 16.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.002 -0.679 . . . . 1.63 110.608 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 35.3 mm -64.97 -53.53 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.229 -0.441 . . . . 1.59 112.073 -176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 478' ' ' LYS . 4.7 pt -64.96 -40.14 88.07 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 C-N-CA 119.171 -1.012 . . . . 1.65 110.321 -174.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.496 ' HE2' ' SD ' ' A' ' 482' ' ' MET . 52.8 mttm -63.85 -34.77 78.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.669 -0.412 . . . . 2.97 111.044 176.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 16.3 t -78.52 -14.35 59.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 2.1 110.754 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.404 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 49.2 m -71.69 95.75 1.51 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.153 0.501 . . . . 3.4 110.207 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -80.5 -6.17 57.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 5.5 111.35 -174.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.792 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.6 OUTLIER -68.35 -56.53 8.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.243 -0.435 . . . . 2.32 110.695 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 477' ' ' ARG . 7.9 mm-40 -109.95 92.14 3.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.35 -0.386 . . . . 3.47 110.364 -175.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.674 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 19.9 tp10 -62.13 -66.04 0.6 Allowed 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.655 -0.702 . . . . 2.79 111.172 -178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.2 -45.56 83.65 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.162 -0.472 . . . . 2.63 110.292 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.846 ' HB2' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -59.27 -43.93 92.47 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.75 -0.659 . . . . 2.98 112.156 -178.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 62.2 pttt -67.08 -39.68 86.85 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.514 -0.475 . . . . 2.3 110.461 -177.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 19.6 mtm180 -70.85 -36.13 72.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.26 0.553 . . . . 4.14 110.386 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.71 -50.62 56.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.576 -0.738 . . . . 2.93 109.957 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.456 HD23 HD12 ' A' ' 484' ' ' LEU . 97.0 mt -72.51 -9.43 58.55 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.139 -0.937 . . . . 2.73 110.624 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.496 ' SD ' ' HE2' ' A' ' 469' ' ' LYS . 43.8 ttp -72.37 -58.44 3.39 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.134 -1.062 . . . . 4.93 108.134 170.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.0 m -52.42 -31.99 37.03 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 114.96 -1.018 . . . . 2.46 110.821 176.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.456 HD12 HD23 ' A' ' 481' ' ' LEU . 72.4 mt -85.61 -70.81 0.57 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.914 -0.584 . . . . 2.28 111.963 177.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.84 ' HA ' HG12 ' A' ' 488' ' ' ILE . 60.5 mt -75.93 -37.58 58.54 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.952 -0.299 . . . . 3.19 111.331 -166.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . 0.64 ' OD1' ' HB2' ' A' ' 465' ' ' ARG . 36.8 t70 -68.93 -20.59 64.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.595 0.712 . . . . 3.86 109.508 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.7 -16.59 28.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.189 -0.914 . . . . 2.77 110.529 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.84 HG12 ' HA ' ' A' ' 485' ' ' LEU . 30.3 mm -54.38 -52.78 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 116.626 -0.261 . . . . 2.27 110.994 176.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm 60.27 92.14 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.273 0.559 . . . . 5.28 111.498 -178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -178.43 116.76 0.54 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 111.027 -0.829 . . . . 0.96 111.027 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -54.84 -39.96 69.13 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.091 0.404 . . . . 1.22 112.091 -176.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -71.37 -56.8 5.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.094 0.474 . . . . 2.38 110.455 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.28 -47.07 84.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.729 -0.669 . . . . 1.97 111.203 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.89 -32.21 73.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.77 111.351 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.38 98.59 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.698 -0.482 . . . . 0.68 109.698 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.1 tmtp? -69.46 -43.21 73.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.712 -0.676 . . . . 2.98 110.227 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -66.13 -28.75 69.03 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.15 0.5 . . . . 1.82 111.03 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.557 ' O ' HG23 ' A' ' 502' ' ' VAL . 17.0 t-80 -69.42 -51.06 39.97 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.809 -0.812 . . . . 1.85 108.809 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -61.67 -25.8 67.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.093 -0.958 . . . . 2.63 110.068 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 25.8 ttt -62.22 -52.15 64.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.811 -0.631 . . . . 2.52 110.41 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 504' ' ' ILE . 8.3 mp -70.95 -28.76 64.71 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.378 -0.529 . . . . 2.09 110.609 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 498' ' ' HIS . 76.0 t -61.21 -33.76 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.305 0.574 . . . . 1.11 109.899 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -81.34 -27.79 34.79 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.177 -0.465 . . . . 2.54 110.955 176.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.563 HG22 ' O ' ' A' ' 501' ' ' LEU . 6.1 tp -76.31 -26.06 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.737 -0.385 . . . . 1.75 111.362 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 501' ' ' LEU . 45.3 pt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.756 -0.202 . . . . 2.19 110.87 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.754 0.311 . . . . 2.7 110.742 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.632 ' O ' HG12 ' A' ' 467' ' ' ILE . 44.1 t -61.05 -64.87 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-N 116.03 -0.532 . . . . 1.5 109.957 174.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 498' ' ' HIS . 0.0 OUTLIER -61.63 -35.27 66.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 N-CA-C 109.728 -0.471 . . . . 2.72 109.728 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.518 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 29.7 ttt-85 -55.74 -44.52 77.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.581 -0.736 . . . . 3.37 110.503 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.2 t -82.96 -22.63 33.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.47 -0.332 . . . . 1.63 110.788 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 463' ' ' VAL . 23.2 mm -63.03 -50.48 79.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-N 116.636 -0.256 . . . . 1.59 110.945 178.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.698 HG21 HD23 ' A' ' 481' ' ' LEU . 2.7 pp -65.69 -33.41 63.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 119.0 -1.08 . . . . 1.65 110.569 178.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.669 ' N ' HD12 ' A' ' 468' ' ' ILE . 58.3 mtpt -60.4 -38.35 83.71 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.525 0.202 . . . . 2.97 110.792 177.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.3 p -81.08 -17.5 49.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.368 -0.378 . . . . 2.1 111.056 176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 43.7 m -82.44 97.64 8.49 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.347 0.594 . . . . 3.4 110.109 177.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -100.5 45.93 0.97 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.71 -0.677 . . . . 5.5 111.93 -171.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -90.86 -53.19 4.5 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.562 -0.533 . . . . 2.32 109.562 172.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.553 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 3.9 pt-20 -132.88 92.34 3.03 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.693 -0.685 . . . . 3.47 109.539 176.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 34.2 mt-10 -73.37 -28.79 62.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 2.79 112.589 -170.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -63.78 -38.23 90.31 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.804 -0.758 . . . . 2.63 109.174 172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.524 ' HG2' ' OE2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -62.84 -40.57 97.85 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.03 -0.532 . . . . 2.98 111.212 175.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.656 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 35.7 pttt -66.08 -39.86 90.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.832 0.349 . . . . 2.3 110.14 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.8 -41.83 67.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.359 -0.382 . . . . 4.14 110.667 177.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.53 -48.58 76.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.434 0.635 . . . . 2.93 110.026 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.698 HD23 HG21 ' A' ' 468' ' ' ILE . 35.1 tp -62.98 -36.42 83.47 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-N 115.518 -0.764 . . . . 2.73 110.087 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 35.6 ttm -59.85 -39.46 85.26 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.939 -0.393 . . . . 4.93 109.939 175.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 11.3 m -64.63 -33.76 76.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.432 0.634 . . . . 2.46 110.122 178.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 82.6 mt -76.06 -49.79 16.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.529 -0.76 . . . . 2.28 110.896 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.912 ' HA ' HG12 ' A' ' 488' ' ' ILE . 68.7 mt -60.77 -42.15 96.89 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 123.214 0.606 . . . . 3.19 111.187 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -10.36 14.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.887 -0.597 . . . . 3.86 110.804 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -120.75 -4.41 9.71 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.992 -0.549 . . . . 2.77 110.796 177.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.912 HG12 ' HA ' ' A' ' 485' ' ' LEU . 11.1 mm -57.55 -51.46 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 O-C-N 122.396 -0.19 . . . . 2.27 111.131 -178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 22.7 tptm 72.11 -43.21 0.56 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.592 0.757 . . . . 5.28 111.978 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -59.73 106.37 0.96 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.383 -0.437 . . . . 0.96 112.101 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.689 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -61.22 -41.95 97.75 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.852 0.316 . . . . 1.22 111.852 -174.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -67.33 -34.53 77.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.94 0.4 . . . . 2.38 110.904 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.401 ' HA ' ' HG3' ' A' ' 496' ' ' LYS . 38.1 m-20 -64.49 -42.49 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.903 0.382 . . . . 1.97 110.16 178.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 491' ' ' ALA . 21.0 mt -58.78 -44.49 90.71 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.79 -0.641 . . . . 1.77 110.028 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.78 97.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.431 -0.804 . . . . 0.68 111.561 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -77.9 -26.97 49.42 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.521 -0.472 . . . . 2.98 111.497 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.508 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.7 m-85 -69.02 -30.02 68.31 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.614 0.721 . . . . 1.82 109.326 172.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 464' ' ' ILE . 12.7 t-80 -68.59 -58.9 3.6 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 114.864 -1.062 . . . . 1.85 109.439 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.566 ' HA ' HG12 ' A' ' 502' ' ' VAL . 35.8 tt0 -57.24 -34.52 68.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.641 -0.709 . . . . 2.63 109.728 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 496' ' ' LYS . 55.9 tpp -52.85 -68.12 0.2 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.5 -0.773 . . . . 2.52 111.326 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 1.051 ' HA ' HG22 ' A' ' 504' ' ' ILE . 48.7 mt -83.45 -19.19 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.992 -0.683 . . . . 2.09 112.068 -173.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 499' ' ' GLN . 3.8 p -73.66 -26.0 21.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.582 -0.847 . . . . 1.11 109.483 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -89.78 -30.18 18.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.02 -0.536 . . . . 2.54 110.447 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 1.051 HG22 ' HA ' ' A' ' 501' ' ' LEU . 8.4 tp -79.89 -26.16 12.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.405 -0.518 . . . . 1.75 111.52 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.007 0.432 . . . . 2.19 110.352 177.716 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 111.508 0.188 . . . . 2.7 111.508 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.569 ' HB ' HD12 ' A' ' 464' ' ' ILE . 19.1 t -56.38 -62.78 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 121.028 0.442 . . . . 1.5 110.584 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.741 HG21 ' HG ' ' A' ' 485' ' ' LEU . 3.5 mp -68.5 -37.24 77.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.078 -0.51 . . . . 2.72 110.329 -177.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.443 ' HG2' ' HG3' ' A' ' 482' ' ' MET . 8.0 tmm_? -56.98 -41.07 77.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.052 -0.522 . . . . 3.37 110.185 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 37.2 t -72.88 -44.54 61.21 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.251 -0.432 . . . . 1.63 110.731 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 463' ' ' VAL . 84.2 mt -58.63 -47.43 88.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 111.946 0.35 . . . . 1.59 111.946 -175.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 464' ' ' ILE . 11.1 pt -58.87 -51.41 72.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 C-N-CA 120.285 -0.566 . . . . 1.65 110.884 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.9 ' HA ' ' HD2' ' A' ' 478' ' ' LYS . 72.4 mttt -59.27 -42.07 90.33 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.665 0.269 . . . . 2.97 111.087 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.9 m -69.79 -19.75 63.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.248 -0.433 . . . . 2.1 110.662 -179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 34.4 m -92.32 92.25 8.06 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.934 -0.765 . . . . 3.4 108.934 176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 28.0 ttp180 -72.93 74.21 1.16 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.073 -0.512 . . . . 5.5 110.672 -177.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.83 -77.77 0.53 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.406 -0.961 . . . . 2.32 108.406 174.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.937 ' HG3' ' HB3' ' A' ' 477' ' ' ARG . 6.8 pt-20 -129.53 126.25 38.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.627 -1.17 . . . . 3.47 110.723 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.71 -44.5 90.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.446 -1.252 . . . . 2.79 112.794 -173.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 480' ' ' TYR . 0.8 OUTLIER -67.35 -21.76 65.62 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.437 -0.505 . . . . 2.63 111.069 -176.295 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.937 ' HB3' ' HG3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -85.79 -34.03 21.23 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.049 -0.66 . . . . 2.98 109.977 -176.26 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.9 ' HD2' ' HA ' ' A' ' 469' ' ' LYS . 16.1 pttm -67.03 -35.28 79.55 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 119.625 -0.83 . . . . 2.3 108.869 172.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -74.03 -37.93 64.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.577 -0.738 . . . . 4.14 110.963 175.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 476' ' ' ASP . 58.0 t80 -67.6 -55.47 13.23 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.568 0.699 . . . . 2.93 110.257 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.467 HD23 HD12 ' A' ' 484' ' ' LEU . 79.7 mt -69.12 -23.9 64.05 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.213 -0.903 . . . . 2.73 111.237 -176.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.443 ' HG3' ' HG2' ' A' ' 465' ' ' ARG . 26.0 ttt -65.43 -49.6 68.57 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.007 -0.738 . . . . 4.93 109.007 173.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 19.4 m -53.73 -36.84 62.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.301 -0.863 . . . . 2.46 110.464 176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 488' ' ' ILE . 80.1 mt -76.71 -70.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.666 -0.697 . . . . 2.28 111.854 178.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.741 ' HG ' HG21 ' A' ' 464' ' ' ILE . 4.0 mm? -64.81 -37.23 86.93 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.3 0.482 . . . . 3.19 112.3 -167.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -67.31 -13.39 61.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.247 0.546 . . . . 3.86 110.276 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -113.61 -7.44 13.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.114 -0.494 . . . . 2.77 110.553 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.607 HG21 ' HB2' ' A' ' 493' ' ' ASP . 11.5 mm -61.81 -46.08 97.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.462 -0.335 . . . . 2.27 111.143 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 72.91 -51.54 0.71 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.561 0.744 . . . . 5.28 111.811 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.47 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -64.89 123.19 26.02 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.475 -0.33 . . . . 0.96 113.181 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.608 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -62.2 -21.69 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.599 0.36 . . . . 1.22 111.825 -177.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.93 -56.47 18.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 2.38 110.918 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.607 ' HB2' HG21 ' A' ' 488' ' ' ILE . 52.1 m-20 -71.32 -32.83 69.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 1.97 110.47 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.737 HD23 HD12 ' A' ' 485' ' ' LEU . 96.0 mt -56.16 -59.59 4.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 1.77 110.891 176.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.33 -26.48 68.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.235 -0.439 . . . . 0.68 110.652 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -65.17 -54.65 26.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.933 -0.576 . . . . 2.98 110.642 176.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.476 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 43.1 m-85 -67.77 -21.57 65.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 1.82 111.089 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.521 ' O ' HG23 ' A' ' 502' ' ' VAL . 18.5 t-160 -68.43 -55.53 11.54 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.288 -0.634 . . . . 1.85 109.288 176.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 503' ' ' LYS . 11.5 pt20 -69.87 -18.95 63.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 2.63 109.904 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 497' ' ' PHE . 23.9 ttt -61.45 -48.25 82.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.924 -0.58 . . . . 2.52 110.109 174.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.731 ' HA ' HG22 ' A' ' 504' ' ' ILE . 22.6 mt -71.27 -36.8 71.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 2.09 110.44 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 498' ' ' HIS . 96.4 t -56.07 -35.15 40.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.663 -0.495 . . . . 1.11 109.663 175.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 499' ' ' GLN . 65.0 mttp -73.3 -46.91 46.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.944 -0.571 . . . . 2.54 111.214 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 501' ' ' LEU . 12.1 tt -62.43 -37.11 77.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 N-CA-C 112.203 0.446 . . . . 1.75 112.203 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.636 HG23 HG23 ' A' ' 504' ' ' ILE . 30.4 pt . . . . . 0 C--N 1.326 -0.432 0 C-N-CA 121.158 -0.217 . . . . 2.19 110.97 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.783 0.325 . . . . 2.7 110.428 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . . . . . . . . . 90.3 t -52.43 -64.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 115.542 -0.754 . . . . 1.5 111.372 177.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.523 HG21 ' HB3' ' A' ' 494' ' ' LEU . 8.5 tt -65.78 -39.08 83.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.723 -0.391 . . . . 2.72 110.867 -176.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -56.31 -54.65 42.96 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.105 0.479 . . . . 3.37 110.75 -178.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . 0.494 ' HA ' ' HE3' ' A' ' 469' ' ' LYS . 32.7 t -73.85 -42.39 60.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 1.63 111.177 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . 32.5 mt -63.76 -47.4 91.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 112.281 0.475 . . . . 1.59 112.281 -174.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 481' ' ' LEU . 21.6 pt -67.16 -40.57 85.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 119.166 -1.014 . . . . 1.65 110.644 -175.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 466' ' ' SER . 18.3 pttp -65.53 -31.27 72.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.035 0.445 . . . . 2.97 110.239 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.9 t -77.37 -22.37 51.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 2.1 111.039 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 49.1 m -78.71 97.52 5.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.454 0.645 . . . . 3.4 109.882 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -90.03 34.26 0.86 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.561 -0.745 . . . . 5.5 112.594 -170.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.817 HD11 HD12 ' A' ' 505' ' ' ILE . 2.0 pt? -81.61 -39.71 24.08 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.654 -0.419 . . . . 2.32 110.267 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.709 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 5.3 pt-20 -140.2 115.73 10.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.879 0.847 . . . . 3.47 110.931 175.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 50.3 mm-40 -65.89 -57.34 8.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.29 -1.323 . . . . 2.79 112.038 -171.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.3 -42.25 99.21 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.947 -0.301 . . . . 2.63 111.611 -173.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.409 ' HG2' ' OE1' ' A' ' 474' ' ' GLU . 0.8 OUTLIER -63.16 -46.03 89.09 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.38 -0.528 . . . . 2.98 112.029 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 18.9 pttp -63.91 -37.33 86.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.079 -0.648 . . . . 2.3 110.115 -177.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 475' ' ' GLU . 88.4 mtt180 -65.06 -54.56 28.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.682 -0.69 . . . . 4.14 110.551 174.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.43 -49.76 76.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.613 -0.721 . . . . 2.93 111.005 -177.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.69 HD12 HD11 ' A' ' 484' ' ' LEU . 25.5 tp -63.76 -36.24 83.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.734 -0.666 . . . . 2.73 110.916 -176.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.69 ' HA ' ' HG ' ' A' ' 485' ' ' LEU . 51.6 ttp -70.51 -37.19 74.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.72 0.295 . . . . 4.93 110.214 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 45.7 m -62.51 -34.74 77.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 2.46 110.233 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.69 HD11 HD12 ' A' ' 481' ' ' LEU . 4.4 pp -87.31 -39.73 15.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 2.28 112.02 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' A' ' 494' ' ' LEU . 4.4 pp -62.26 -37.08 84.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 120.145 -0.622 . . . . 3.19 109.885 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . 0.531 ' N ' HD12 ' A' ' 485' ' ' LEU . 35.5 t70 -55.58 -19.34 9.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.831 -1.077 . . . . 3.86 111.825 175.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 28.1 t70 -118.14 -3.45 11.07 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.751 0.278 . . . . 2.77 111.751 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' A' ' 494' ' ' LEU . 37.0 mt -64.87 -37.57 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 O-C-N 121.894 -0.504 . . . . 2.27 111.006 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 487' ' ' ASP . 20.6 mtpt 63.0 19.4 11.62 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.497 -0.774 . . . . 5.28 112.573 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.657 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -123.63 112.93 1.97 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.965 -0.636 . . . . 0.96 111.543 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.03 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.033 0.383 . . . . 1.22 112.033 -174.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -70.83 -38.48 73.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.136 0.493 . . . . 2.38 110.471 -177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -66.25 -38.76 88.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.851 -0.613 . . . . 1.97 110.675 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' A' ' 485' ' ' LEU . 83.2 mt -63.27 -44.55 94.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.859 0.361 . . . . 1.77 110.502 178.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.88 84.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.178 0.513 . . . . 0.68 110.165 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 496' ' ' LYS . 5.5 tmmm? -68.3 -42.28 79.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.447 -0.797 . . . . 2.98 110.671 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.31 -30.75 71.64 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.351 0.596 . . . . 1.82 110.904 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.565 ' O ' HG23 ' A' ' 502' ' ' VAL . 11.6 t-160 -70.71 -52.93 17.75 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.75 -0.659 . . . . 1.85 109.379 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -61.75 -27.0 68.42 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.864 -0.607 . . . . 2.63 109.862 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -57.74 -55.23 37.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.972 -0.558 . . . . 2.52 109.901 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.27 -26.02 62.71 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.25 -0.58 . . . . 2.09 110.999 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 498' ' ' HIS . 91.3 t -61.55 -46.22 97.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.332 -0.547 . . . . 1.11 109.599 173.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -62.67 -37.8 87.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.831 -0.622 . . . . 2.54 110.898 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.633 HG22 HG23 ' A' ' 505' ' ' ILE . 48.9 mm -80.58 -71.8 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-O 121.142 0.496 . . . . 1.75 112.143 -178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.817 HD12 HD11 ' A' ' 473' ' ' LEU . 13.9 pt . . . . . 0 C--N 1.32 -0.69 0 CA-C-N 115.828 -0.624 . . . . 2.19 112.298 -172.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 114.702 1.371 . . . . 2.7 114.702 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 467' ' ' ILE . 42.3 t -67.33 -68.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.032 -0.531 . . . . 1.5 112.091 -165.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.608 ' O ' HG13 ' A' ' 468' ' ' ILE . 11.3 tt -59.68 -41.52 85.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.021 -0.536 . . . . 2.72 112.11 -171.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.546 ' HD2' ' HG3' ' A' ' 482' ' ' MET . 29.4 ttp180 -75.27 -31.47 60.76 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.251 -0.579 . . . . 3.37 110.622 -175.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 38.7 t -67.34 -46.6 72.97 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.312 0.577 . . . . 1.63 110.008 173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 463' ' ' VAL . 35.2 mm -63.78 -49.0 83.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.546 -0.752 . . . . 1.59 112.308 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.739 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.6 pp -66.34 -39.9 85.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.506 -0.878 . . . . 1.65 111.728 -176.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.739 ' N ' HD12 ' A' ' 468' ' ' ILE . 41.2 mtmt -62.05 -37.32 84.53 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 109.525 -0.546 . . . . 2.97 109.525 176.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 38.7 m -68.69 -25.03 64.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.674 -0.694 . . . . 2.1 110.494 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 46.3 m -84.49 63.15 7.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.598 0.713 . . . . 3.4 109.561 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -64.56 -5.6 5.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.86 -1.063 . . . . 5.5 112.894 -175.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.688 HD11 HG21 ' A' ' 505' ' ' ILE . 1.0 OUTLIER -61.1 -41.43 96.66 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.738 -0.838 . . . . 2.32 108.738 170.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.718 ' O ' ' HB3' ' A' ' 478' ' ' LYS . 67.6 mm-40 -97.4 69.31 2.23 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.554 -1.203 . . . . 3.47 109.229 176.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.714 ' O ' ' HG2' ' A' ' 479' ' ' ARG . 13.1 tp10 -53.61 -61.06 2.54 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-O 121.168 0.509 . . . . 2.79 109.92 178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.754 ' HA ' ' HE ' ' A' ' 479' ' ' ARG . 23.4 m-20 -56.82 -55.89 28.52 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.12 -0.946 . . . . 2.63 111.151 -178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -63.75 -36.08 82.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.395 0.517 . . . . 2.98 112.395 -175.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.718 ' HB3' ' O ' ' A' ' 474' ' ' GLU . 0.5 OUTLIER -57.27 -57.21 13.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.632 0.196 . . . . 2.3 111.333 175.389 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . 0.754 ' HE ' ' HA ' ' A' ' 476' ' ' ASP . 28.7 ptt180 -71.18 -29.42 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 122.169 -0.332 . . . . 4.14 111.809 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -63.26 -54.52 35.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.687 0.756 . . . . 2.93 109.748 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 0.5 OUTLIER -65.61 -27.56 68.49 Favored 'General case' 0 C--O 1.206 -1.187 0 CA-C-N 114.911 -1.04 . . . . 2.73 109.848 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.546 ' HG3' ' HD2' ' A' ' 465' ' ' ARG . 25.7 ttt -65.84 -48.31 72.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.34 0.114 . . . . 4.93 110.875 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 32.7 m -59.86 -37.32 78.96 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.868 0.366 . . . . 2.46 110.376 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.407 ' O ' HG12 ' A' ' 488' ' ' ILE . 88.1 mt -77.16 -39.02 50.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.866 -0.606 . . . . 2.28 111.615 178.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 488' ' ' ILE . 3.3 tm? -67.0 -40.78 87.42 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 122.576 0.35 . . . . 3.19 110.561 -173.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -7.88 3.94 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.379 -0.528 . . . . 3.86 111.777 174.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -115.12 -11.08 12.1 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.996 0.427 . . . . 2.77 110.335 173.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' A' ' 485' ' ' LEU . 11.7 mm -63.65 126.72 22.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.285 0.564 . . . . 2.27 110.905 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -107.31 111.96 24.57 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.395 -0.82 . . . . 5.28 109.426 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 130.7 105.25 1.07 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.612 -0.804 . . . . 0.96 112.243 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -65.5 -32.05 73.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.033 0.444 . . . . 1.22 110.951 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -76.72 -31.2 57.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.424 0.631 . . . . 2.38 109.699 178.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.79 -48.04 70.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.339 -0.846 . . . . 1.97 110.37 178.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.573 ' HA ' ' HD2' ' A' ' 497' ' ' PHE . 4.5 pp -68.48 -26.82 65.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.57 -0.286 . . . . 1.77 110.652 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 498' ' ' HIS . . . -64.32 -35.43 80.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.115 0.483 . . . . 0.68 109.943 173.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 496' ' ' LYS . 2.2 tmmm? -73.63 -36.89 65.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.604 . . . . 2.98 109.896 177.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.573 ' HD2' ' HA ' ' A' ' 494' ' ' LEU . 36.2 m-85 -65.34 -28.39 69.26 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.629 0.728 . . . . 1.82 110.124 174.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' ' 502' ' ' VAL . 41.3 t-80 -67.75 -54.38 19.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.077 -0.965 . . . . 1.85 108.561 176.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -55.67 -29.62 59.63 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.551 -0.749 . . . . 2.63 110.891 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.528 ' O ' HG13 ' A' ' 504' ' ' ILE . 46.1 ttp -58.66 -63.63 1.22 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.856 -0.611 . . . . 2.52 110.375 -178.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 468' ' ' ILE . 7.0 mp -68.44 -25.17 64.88 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 119.756 -0.778 . . . . 2.09 110.761 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 498' ' ' HIS . 40.1 t -59.45 -44.91 93.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.84 -0.344 . . . . 1.11 111.033 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -84.32 -16.25 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.102 -0.639 . . . . 2.54 111.029 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 500' ' ' MET . 78.4 mt -69.45 -61.88 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-O 120.875 0.369 . . . . 1.75 111.023 173.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.688 HG21 HD11 ' A' ' 473' ' ' LEU . 22.9 pt . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.199 -0.455 . . . . 2.19 111.263 -173.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.982 0.42 . . . . 2.7 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 467' ' ' ILE . 48.7 t -61.91 -51.31 74.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 1.5 111.077 -178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.505 HD13 ' HG ' ' A' ' 485' ' ' LEU . 15.6 tt -71.57 -37.14 62.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.939 -0.304 . . . . 2.72 110.974 -177.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -64.5 -40.87 96.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.99 0.424 . . . . 3.37 110.229 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 22.7 t -67.53 -48.16 67.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 1.63 110.379 178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 463' ' ' VAL . 27.5 mm -59.39 -50.03 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 116.155 -0.475 . . . . 1.59 111.686 -176.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.618 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 13.0 pt -62.82 -42.63 97.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 119.945 -0.702 . . . . 1.65 110.758 -177.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -64.01 -26.61 68.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.717 0.294 . . . . 2.97 111.144 177.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 74.1 m -94.71 -8.48 37.62 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.182 0.438 . . . . 2.1 112.182 177.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.489 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 69.3 m -79.39 103.63 9.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.408 0.623 . . . . 3.4 110.496 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -90.99 76.59 6.2 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.583 -0.735 . . . . 5.5 111.264 -172.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.703 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.0 pt? -145.57 -59.9 0.33 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.407 -0.361 . . . . 2.32 110.882 174.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.703 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 6.9 pt-20 -121.75 92.84 3.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.764 0.792 . . . . 3.47 109.909 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.837 ' HA ' ' HD3' ' A' ' 478' ' ' LYS . 33.9 mt-10 -73.5 -22.61 60.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.098 -0.955 . . . . 2.79 112.111 -171.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.879 ' HB2' HH21 ' A' ' 477' ' ' ARG . 13.3 m-20 -62.24 -46.71 87.64 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 109.052 -0.721 . . . . 2.63 109.052 172.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.879 HH21 ' HB2' ' A' ' 476' ' ' ASP . 0.0 OUTLIER -64.3 -36.2 83.33 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.278 -0.419 . . . . 2.98 111.693 175.015 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.837 ' HD3' ' HA ' ' A' ' 475' ' ' GLU . 53.3 mtpt -51.06 -55.67 16.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.933 0.397 . . . . 2.3 110.503 174.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -68.44 -47.02 68.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 4.14 111.428 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.414 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 37.1 t80 -59.13 -53.46 58.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.93 -0.577 . . . . 2.93 111.149 -177.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.598 HD23 HD12 ' A' ' 484' ' ' LEU . 93.9 mt -71.28 -23.52 61.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.948 -0.569 . . . . 2.73 111.204 -178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . . . . . . . . . 27.2 ttt -63.5 -51.97 63.24 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.022 -0.733 . . . . 4.93 109.022 173.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 42.0 m -58.67 -36.54 74.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.399 -0.819 . . . . 2.46 111.044 177.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 488' ' ' ILE . 59.9 mt -73.66 -65.04 0.87 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.748 -0.66 . . . . 2.28 111.976 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.724 HD13 HG13 ' A' ' 488' ' ' ILE . 3.9 mm? -70.23 -35.44 73.85 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 120.528 -0.469 . . . . 3.19 111.553 -169.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -78.71 45.98 0.63 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 122.84 1.305 . . . . 3.86 108.817 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 485' ' ' LEU . 22.5 t70 -165.39 -27.27 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.069 -1.878 . . . . 2.77 107.81 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.724 HG13 HD13 ' A' ' 485' ' ' LEU . 10.6 mm -66.34 107.21 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.385 -0.825 . . . . 2.27 110.852 173.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 489' ' ' LYS . 6.1 ttpm? -87.28 64.81 8.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.366 0.603 . . . . 5.28 109.684 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.426 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -154.08 112.16 0.52 Allowed Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.459 -0.792 . . . . 0.96 111.561 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -60.85 -48.84 79.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.614 0.245 . . . . 1.22 111.537 -175.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . 0.426 HD22 ' N ' ' A' ' 492' ' ' ASN . 0.1 OUTLIER -63.95 -29.25 70.43 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.392 -0.367 . . . . 2.38 111.549 -179.211 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.447 ' O ' ' HD1' ' A' ' 497' ' ' PHE . 12.4 m-20 -68.53 -54.76 14.69 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.715 -0.476 . . . . 1.97 109.715 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.694 HD23 HD12 ' A' ' 485' ' ' LEU . 69.6 mt -53.44 -43.71 68.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.407 -0.815 . . . . 1.77 110.383 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.46 91.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.342 -0.844 . . . . 0.68 111.082 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.55 69.78 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 110.382 -0.229 . . . . 2.98 110.382 -176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.447 ' HD1' ' O ' ' A' ' 493' ' ' ASP . 69.8 m-85 -65.66 -30.17 70.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.823 0.344 . . . . 1.82 111.358 -178.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 464' ' ' ILE . 41.9 t-80 -70.03 -55.91 8.33 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.927 -0.768 . . . . 1.85 108.927 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.578 ' O ' ' HB2' ' A' ' 503' ' ' LYS . 46.6 mt-30 -56.94 -32.01 65.55 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.031 -0.986 . . . . 2.63 109.589 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.561 ' O ' HG12 ' A' ' 504' ' ' ILE . 55.2 ttp -59.77 -65.24 0.71 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.011 -0.54 . . . . 2.52 111.137 -177.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 2.6 pp -72.2 -28.55 63.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.059 -0.519 . . . . 2.09 112.185 -174.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.433 ' HA ' HG12 ' A' ' 505' ' ' ILE . 9.5 p -74.12 -25.58 20.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 119.827 -0.749 . . . . 1.11 109.562 176.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 75.9 tttt -78.9 -22.62 45.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 2.54 109.572 174.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 500' ' ' MET . 46.2 mm -72.08 -49.11 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.764 -0.653 . . . . 1.75 111.032 173.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 502' ' ' VAL . 36.0 pt . . . . . 0 N--CA 1.464 0.265 0 N-CA-C 112.305 0.483 . . . . 2.19 112.305 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 112.464 0.542 . . . . 2.7 112.464 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 467' ' ' ILE . 74.9 t -61.09 -58.41 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.715 0.293 . . . . 1.5 110.9 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.474 HG12 ' HB3' ' A' ' 494' ' ' LEU . 2.3 mp -62.72 -48.35 88.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.308 -0.406 . . . . 2.72 110.53 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -55.25 -46.04 76.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.95 -0.568 . . . . 3.37 111.705 -178.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 21.0 m -71.84 -46.84 56.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.723 0.297 . . . . 1.63 111.041 -177.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 463' ' ' VAL . 38.6 mm -61.0 -45.34 98.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.395 -0.366 . . . . 1.59 111.478 -175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 482' ' ' MET . 4.3 pt -66.28 -44.13 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.006 -0.678 . . . . 1.65 110.178 -178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.784 ' HA ' ' HB3' ' A' ' 478' ' ' LYS . 55.7 mtpt -65.35 -20.91 66.6 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.815 0.34 . . . . 2.97 111.176 178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.3 t -97.79 -15.62 20.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.623 -0.262 . . . . 2.1 111.527 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.47 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 88.6 p -70.26 128.82 37.55 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.113 0.483 . . . . 3.4 111.128 -175.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -81.37 72.85 8.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.188 0.518 . . . . 5.5 111.14 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.424 ' HB2' ' H ' ' A' ' 474' ' ' GLU . 2.6 mt -114.4 -78.47 0.58 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.334 -0.988 . . . . 2.32 108.334 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.759 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 77.7 mm-40 -146.92 134.01 20.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.152 -1.386 . . . . 3.47 107.602 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.677 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 12.0 pt-20 -69.17 -29.75 67.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.281 -0.568 . . . . 2.79 110.822 -176.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.81 -45.04 94.49 Favored 'General case' 0 C--O 1.205 -1.288 0 N-CA-C 108.669 -0.863 . . . . 2.63 108.669 170.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.759 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -58.13 -38.83 77.29 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.506 0.504 . . . . 2.98 111.642 177.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.784 ' HB3' ' HA ' ' A' ' 469' ' ' LYS . 44.9 mtmt -64.61 -41.78 95.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.786 0.327 . . . . 2.3 110.164 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -75.94 -31.92 59.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.442 0.639 . . . . 4.14 110.7 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -65.79 -56.28 12.77 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.041 -0.981 . . . . 2.93 109.438 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 485' ' ' LEU . 96.9 mt -73.87 -17.7 61.02 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 114.247 -1.342 . . . . 2.73 110.78 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.546 ' O ' ' HB3' ' A' ' 486' ' ' ASP . 51.3 ttp -61.25 -64.46 0.94 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.598 -0.89 . . . . 4.93 108.598 172.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 25.3 m -58.45 -38.82 78.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.057 -0.974 . . . . 2.46 111.705 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 75.9 mt -87.05 -60.18 2.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.484 0.55 . . . . 2.28 112.484 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.6 ' O ' HG12 ' A' ' 488' ' ' ILE . 53.8 tp -72.53 -44.22 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.181 -0.208 . . . . 3.19 110.948 -169.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 482' ' ' MET . 26.6 t70 -65.48 -14.02 60.08 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.316 0.579 . . . . 3.86 110.421 -174.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . 0.407 ' O ' ' C ' ' A' ' 488' ' ' ILE . 10.1 t70 -106.4 -20.27 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.551 -0.737 . . . . 2.77 112.591 -179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 489' ' ' LYS . 27.3 mm -10.66 -75.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 113.893 1.072 . . . . 2.27 113.893 -170.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.766 ' HG2' HG22 ' A' ' 488' ' ' ILE . 21.6 pttp -176.39 -49.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 111.545 0.202 . . . . 5.28 111.545 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.476 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -129.9 157.32 21.84 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.349 -0.929 . . . . 0.96 112.48 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.698 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -66.13 -28.46 68.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.658 0.266 . . . . 1.22 111.011 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.45 -48.74 78.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 2.38 110.362 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.44 ' O ' ' HD2' ' A' ' 497' ' ' PHE . 10.2 m-20 -64.9 -44.19 90.4 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.509 -0.769 . . . . 1.97 109.7 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 491' ' ' ALA . 93.2 mt -53.94 -54.13 43.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.138 -0.937 . . . . 1.77 111.349 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.8 -40.85 96.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.027 -0.533 . . . . 0.68 110.837 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 500' ' ' MET . 57.8 tptt -60.43 -58.38 8.74 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.974 -0.557 . . . . 2.98 110.96 179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 493' ' ' ASP . 74.2 m-85 -65.17 -23.66 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.964 0.412 . . . . 1.82 111.454 -178.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.54 ' O ' HG23 ' A' ' 502' ' ' VAL . 27.5 t-80 -69.97 -53.49 17.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.295 -0.631 . . . . 1.85 109.295 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.15 -29.53 70.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.511 -0.768 . . . . 2.63 109.525 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.506 ' O ' HG13 ' A' ' 504' ' ' ILE . 88.4 mtp -59.85 -55.57 32.57 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.916 -0.584 . . . . 2.52 111.099 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 504' ' ' ILE . 4.5 mm? -64.83 -31.88 73.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.7 -0.227 . . . . 2.09 111.088 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 498' ' ' HIS . 92.8 t -60.51 -41.32 87.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.966 0.412 . . . . 1.11 109.942 174.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.36 -24.14 61.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.131 -0.486 . . . . 2.54 111.037 175.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.651 HD12 HD13 ' A' ' 501' ' ' LEU . 62.0 mt -74.38 -40.61 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.438 -0.346 . . . . 1.75 111.789 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 501' ' ' LEU . 28.2 pt . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 111.991 0.367 . . . . 2.19 111.991 -175.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . 0.455 ' HA ' ' HB3' ' A' ' 465' ' ' ARG . 4.4 t . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.484 0.183 . . . . 2.7 110.868 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 467' ' ' ILE . 61.1 t -59.99 -72.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.534 -0.303 . . . . 1.5 110.529 175.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.964 HD13 ' HA ' ' A' ' 498' ' ' HIS . 6.4 tp -63.58 -31.65 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.813 0.34 . . . . 2.72 110.12 -178.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.455 ' HB3' ' HA ' ' A' ' 462' ' ' SER . 34.7 ttt180 -48.57 -56.26 8.87 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.337 -0.847 . . . . 3.37 110.361 173.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 7.6 m -82.11 -30.71 31.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.643 -0.708 . . . . 1.63 111.443 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 463' ' ' VAL . 20.3 mm -56.89 -49.16 79.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.96 -0.109 . . . . 1.59 111.083 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.532 HG22 HD12 ' A' ' 501' ' ' LEU . 46.0 pt -61.2 -45.9 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 119.853 -0.739 . . . . 1.65 109.822 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 469' ' ' LYS . 45.8 mtpt -58.04 -28.73 64.78 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.885 0.374 . . . . 2.97 111.567 178.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 17.1 m -83.45 -25.37 31.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.337 -0.392 . . . . 2.1 111.029 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.419 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 20.3 m -71.25 117.84 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.73 0.3 . . . . 3.4 110.346 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 472' ' ' ARG . 10.1 ttp180 -80.84 56.27 2.66 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.261 0.553 . . . . 5.5 111.925 -173.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.627 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -146.9 162.5 38.54 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.755 -0.831 . . . . 2.32 108.755 171.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.946 ' HB2' ' HB2' ' A' ' 477' ' ' ARG . 1.7 pt-20 30.47 84.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.629 0.974 . . . . 3.47 113.629 -176.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.885 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 1.9 mp0 -64.82 -41.31 95.87 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 116.045 -0.525 . . . . 2.79 111.445 -177.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.01 -40.2 80.17 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 109.416 -0.587 . . . . 2.63 109.416 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.946 ' HB2' ' HB2' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -66.36 -42.39 88.12 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 114.849 -1.069 . . . . 2.98 110.434 -177.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.885 ' HE2' ' HA ' ' A' ' 475' ' ' GLU . 21.2 mtmm -55.31 -53.91 50.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 120.642 -0.423 . . . . 2.3 110.641 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -67.05 -42.86 84.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.836 -0.62 . . . . 4.14 111.066 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.13 -56.17 16.71 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.56 0.695 . . . . 2.93 110.721 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 484' ' ' LEU . 96.9 mt -70.3 -25.91 63.54 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.421 -0.809 . . . . 2.73 111.734 -174.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.437 ' HG3' ' HD2' ' A' ' 469' ' ' LYS . 14.0 tmm? -69.69 -42.45 74.08 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.15 -0.685 . . . . 4.93 109.15 175.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 53.5 m -61.13 -33.44 73.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.821 -0.627 . . . . 2.46 110.318 176.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 481' ' ' LEU . 83.0 mt -73.96 -54.31 8.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.803 -0.635 . . . . 2.28 111.347 174.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.797 ' HA ' HG12 ' A' ' 488' ' ' ILE . 87.8 mt -56.32 -39.87 73.46 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 120.619 0.247 . . . . 3.19 110.719 -177.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.31 -32.25 16.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.353 -0.839 . . . . 3.86 111.855 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -123.44 18.36 9.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.821 0.304 . . . . 2.77 111.821 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.797 HG12 ' HA ' ' A' ' 485' ' ' LEU . 8.2 mm -57.53 -41.34 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 121.099 -0.24 . . . . 2.27 110.864 173.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 28.7 tptp 72.46 -50.05 0.7 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.807 0.692 . . . . 5.28 112.063 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -70.6 125.97 14.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.399 -0.429 . . . . 0.96 112.805 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.19 78.69 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.317 0.247 . . . . 1.22 111.606 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.65 -43.31 97.76 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.765 0.316 . . . . 2.38 110.935 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 496' ' ' LYS . 18.3 m-20 -73.16 -43.68 61.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.039 -0.528 . . . . 1.97 111.936 -176.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 495' ' ' ALA . 3.2 pp -68.03 -34.31 76.24 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.325 -0.55 . . . . 1.77 110.759 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.563 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -70.69 -36.15 73.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.461 -0.336 . . . . 0.68 110.538 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.562 ' HD2' ' N ' ' A' ' 497' ' ' PHE . 0.0 OUTLIER -73.6 -31.91 63.82 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 120.513 -0.475 . . . . 2.98 110.178 178.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.562 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 12.1 m-85 -68.21 -30.68 69.81 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.264 0.554 . . . . 1.82 109.569 173.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.964 ' HA ' HD13 ' A' ' 464' ' ' ILE . 38.2 t-80 -67.86 -61.01 2.07 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.683 -0.858 . . . . 1.85 108.683 178.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -52.02 -38.76 58.0 Favored 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 123.896 0.747 . . . . 2.63 109.859 177.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.554 ' O ' HG13 ' A' ' 504' ' ' ILE . 26.4 ttt -52.75 -74.13 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.271 -0.877 . . . . 2.52 111.278 -177.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 504' ' ' ILE . 79.5 mt -78.82 -26.89 44.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.632 -0.427 . . . . 2.09 111.91 -172.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 1.8 p -69.78 -31.36 48.1 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 120.031 -0.667 . . . . 1.11 110.005 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -84.28 -30.27 25.75 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.37 -0.532 . . . . 2.54 110.269 174.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 501' ' ' LEU . 42.7 mt -58.01 -41.9 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 120.815 -0.354 . . . . 1.75 110.672 173.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.399 -0.364 . . . . 2.19 111.481 -179.399 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.896 0.379 . . . . 2.7 111.099 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 467' ' ' ILE . 46.4 t -64.18 -58.39 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.5 110.976 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.493 HG12 ' HB2' ' A' ' 498' ' ' HIS . 0.3 OUTLIER -67.47 -34.47 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-O 121.068 0.461 . . . . 2.72 110.384 -175.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 469' ' ' LYS . 36.0 ttp180 -64.09 -40.61 96.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 3.37 109.842 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 25.8 t -66.76 -37.84 85.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 1.63 110.087 175.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.636 HG13 ' CD2' ' A' ' 498' ' ' HIS . 32.1 mm -61.44 -53.7 45.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.052 -0.522 . . . . 1.59 111.826 -177.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.971 ' HB ' ' HB2' ' A' ' 478' ' ' LYS . 2.2 pp -64.52 -35.86 75.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 C-N-CA 119.011 -1.075 . . . . 1.65 110.353 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.675 ' N ' HD12 ' A' ' 468' ' ' ILE . 56.0 mtpt -59.76 -37.26 78.51 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 110.299 -0.26 . . . . 2.97 110.299 177.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 22.8 t -81.46 -23.15 37.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.229 -0.441 . . . . 2.1 111.107 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . . . . . . . . . 55.5 m -71.64 100.67 2.35 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.127 0.489 . . . . 3.4 110.735 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . 0.617 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -88.18 64.7 7.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.527 0.679 . . . . 5.5 111.981 -173.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.817 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.4 pt? -121.24 -60.97 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.351 -0.386 . . . . 2.32 111.104 175.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.817 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 9.4 pt-20 -140.87 111.56 6.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.401 0.619 . . . . 3.47 110.652 179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 1.065 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . 22.8 mt-10 -73.15 -57.8 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.487 1.291 . . . . 2.79 114.487 -165.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' A' ' 479' ' ' ARG . 2.0 p-10 -71.95 -25.52 61.91 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.264 -0.975 . . . . 2.63 110.256 -175.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -48.94 79.66 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.489 -0.323 . . . . 2.98 111.435 170.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 1.065 ' HE3' ' HA ' ' A' ' 475' ' ' GLU . 14.4 pttp -76.23 -30.35 57.88 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 120.803 0.335 . . . . 2.3 110.556 -178.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' A' ' 476' ' ' ASP . 11.8 mmm180 -60.51 -47.67 85.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.157 0.503 . . . . 4.14 110.192 169.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -65.22 -43.72 90.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.573 0.702 . . . . 2.93 109.621 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.4 -41.71 90.06 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 114.774 -1.103 . . . . 2.73 111.072 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.488 ' HB3' HG12 ' A' ' 468' ' ' ILE . 4.1 ppp? -74.92 -30.73 61.34 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.653 -0.419 . . . . 4.93 110.817 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 56.9 m -61.82 -37.37 84.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 121.524 0.678 . . . . 2.46 109.368 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 488' ' ' ILE . 89.7 mt -81.66 -49.33 10.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.066 -0.97 . . . . 2.28 111.107 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.968 ' HA ' HG12 ' A' ' 488' ' ' ILE . 54.2 tp -60.76 -40.31 91.99 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.546 -0.297 . . . . 3.19 111.532 -169.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -51.45 -27.91 11.63 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.723 0.639 . . . . 3.86 110.681 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -134.32 24.41 3.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.255 -0.429 . . . . 2.77 111.597 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.968 HG12 ' HA ' ' A' ' 485' ' ' LEU . 20.5 mm -59.26 -69.45 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.817 -0.552 . . . . 2.27 110.862 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -141.78 -70.11 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.697 0.284 . . . . 5.28 110.662 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -166.39 -160.39 13.57 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.374 -0.917 . . . . 0.96 112.626 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 494' ' ' LEU . . . -69.95 -31.37 69.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.726 0.269 . . . . 1.22 111.726 -174.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -62.5 -38.88 91.62 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.37 0.605 . . . . 2.38 109.94 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -77.03 -41.06 44.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.59 -0.732 . . . . 1.97 110.149 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.745 HD23 ' HG ' ' A' ' 485' ' ' LEU . 97.9 mt -54.07 -47.51 71.61 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.921 -0.582 . . . . 1.77 110.093 174.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.09 83.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.473 -0.785 . . . . 0.68 110.753 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -60.98 -56.27 23.09 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.445 -0.343 . . . . 2.98 111.049 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 500' ' ' MET . 32.6 m-85 -70.02 -18.36 63.3 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.214 0.531 . . . . 1.82 111.153 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.636 ' CD2' HG13 ' A' ' 467' ' ' ILE . 31.8 t-80 -69.17 -60.61 2.23 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.064 -0.717 . . . . 1.85 109.064 174.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.631 ' HA ' HG12 ' A' ' 502' ' ' VAL . 29.3 tt0 -64.25 -26.46 68.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.053 -0.976 . . . . 2.63 109.934 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.513 ' HB3' ' HA ' ' A' ' 497' ' ' PHE . 26.1 ttt -63.75 -57.04 11.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.172 -0.467 . . . . 2.52 111.361 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 468' ' ' ILE . 49.8 mt -75.13 -30.27 60.76 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.43 -0.508 . . . . 2.09 110.998 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.631 HG12 ' HA ' ' A' ' 499' ' ' GLN . 10.0 p -74.52 -17.65 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 119.71 -0.796 . . . . 1.11 109.655 174.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 499' ' ' GLN . 49.8 tttp -78.52 -28.39 46.19 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.316 0.579 . . . . 2.54 109.644 171.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 501' ' ' LEU . 44.6 mt -63.23 -37.24 78.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.047 -0.524 . . . . 1.75 109.672 171.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 64.7 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.705 -0.68 . . . . 2.19 110.571 174.454 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 113.295 0.85 . . . . 2.7 113.295 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 467' ' ' ILE . 24.0 t -54.77 -73.64 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.937 0.399 . . . . 1.5 110.932 -175.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 498' ' ' HIS . 51.1 mm -74.8 -31.91 27.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.449 -0.341 . . . . 2.72 111.247 -175.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.438 ' HD3' ' HG3' ' A' ' 482' ' ' MET . 3.0 tmm_? -62.53 -37.5 86.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.818 -0.353 . . . . 3.37 110.28 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 17.7 m -80.93 -37.24 29.87 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.793 -0.363 . . . . 1.63 110.626 177.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.559 HD12 HD13 ' A' ' 464' ' ' ILE . 49.4 mt -56.0 -53.88 33.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.611 -0.268 . . . . 1.59 111.372 178.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.72 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -59.06 -42.11 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 C-N-CA 120.119 -0.633 . . . . 1.65 110.863 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.72 ' N ' HD12 ' A' ' 468' ' ' ILE . 18.4 mmtp -55.83 -46.98 77.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.607 0.241 . . . . 2.97 110.866 177.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 35.7 p -74.02 -18.29 60.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.235 -0.439 . . . . 2.1 111.809 -178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 473' ' ' LEU . 33.1 p -93.29 103.81 16.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.398 0.618 . . . . 3.4 110.917 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . . . . . . . . . 15.4 mtm105 -88.67 45.34 1.28 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.643 -0.708 . . . . 5.5 111.499 -178.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 1.022 ' HG ' ' HG2' ' A' ' 474' ' ' GLU . 2.7 pt? -85.76 -39.79 16.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.801 -0.444 . . . . 2.32 109.801 178.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 1.022 ' HG2' ' HG ' ' A' ' 473' ' ' LEU . 4.3 pt-20 -150.73 111.79 4.34 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 121.737 0.78 . . . . 3.47 110.451 175.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 40.4 mm-40 -63.39 -49.74 72.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.529 -1.214 . . . . 2.79 112.45 -172.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.19 -33.46 75.81 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.66 -0.416 . . . . 2.63 110.852 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 477' ' ' ARG . 0.0 OUTLIER -57.49 -55.13 38.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.452 0.168 . . . . 2.98 110.952 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 45.5 pttt -63.54 -36.44 83.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 2.3 110.679 -176.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -64.22 -50.83 66.51 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.173 0.511 . . . . 4.14 111.239 175.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.516 ' CZ ' HD11 ' A' ' 484' ' ' LEU . 34.2 t80 -62.53 -51.42 67.47 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.567 -0.742 . . . . 2.93 110.786 -179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 481' ' ' LEU . 4.0 mm? -64.22 -35.19 80.0 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.597 -0.728 . . . . 2.73 111.827 -177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.572 ' SD ' ' HE3' ' A' ' 469' ' ' LYS . 24.0 ttt -64.84 -40.8 95.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.874 0.306 . . . . 4.93 110.619 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.4 m -65.41 -35.17 80.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.138 -0.483 . . . . 2.46 110.287 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.557 ' O ' HG12 ' A' ' 488' ' ' ILE . 85.7 mt -74.9 -53.2 9.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.722 -0.672 . . . . 2.28 111.281 176.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.625 ' HA ' ' CG1' ' A' ' 488' ' ' ILE . 94.5 mt -56.11 -40.51 73.83 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 122.873 0.469 . . . . 3.19 111.391 -176.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -50.42 -24.41 3.05 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.553 -0.749 . . . . 3.86 111.571 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . 0.555 ' HA ' ' HE3' ' A' ' 489' ' ' LYS . 19.4 t70 -109.22 -14.94 14.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.544 -0.298 . . . . 2.77 111.544 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.625 ' CG1' ' HA ' ' A' ' 485' ' ' LEU . 13.0 mm -61.94 -46.1 97.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.098 0 CA-C-O 121.32 0.581 . . . . 2.27 110.932 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 487' ' ' ASP . 74.8 mttt 59.42 23.36 11.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.748 -1.115 . . . . 5.28 112.431 171.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -116.94 128.58 7.96 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.403 -0.903 . . . . 0.96 112.943 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 494' ' ' LEU . . . -76.12 -35.83 59.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.118 0.485 . . . . 1.22 109.989 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -60.56 -39.47 88.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.744 -0.662 . . . . 2.38 110.236 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . 0.5 ' HA ' ' HB3' ' A' ' 496' ' ' LYS . 9.0 m-20 -71.91 -26.85 62.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.824 -0.625 . . . . 1.97 110.672 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 491' ' ' ALA . 49.7 mt -58.72 -52.55 65.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.891 -0.411 . . . . 1.77 109.891 171.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -62.03 -33.13 73.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.054 0.454 . . . . 0.68 110.172 178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' A' ' 500' ' ' MET . 2.0 tmtp? -62.91 -51.62 66.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 2.98 110.786 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -73.13 -14.92 61.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.156 0.503 . . . . 1.82 110.959 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.632 ' HB2' HD11 ' A' ' 464' ' ' ILE . 35.6 t-80 -73.34 -52.9 12.19 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.125 -1.065 . . . . 1.85 108.125 176.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -52.43 -41.51 63.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.341 -0.845 . . . . 2.63 109.542 173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.582 ' O ' HG12 ' A' ' 504' ' ' ILE . 90.4 mmm -55.71 -73.22 0.06 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.504 -0.771 . . . . 2.52 112.192 -176.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 7.0 mp -71.39 -30.07 65.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.886 0.328 . . . . 2.09 111.886 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.2 -28.05 37.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.347 -0.541 . . . . 1.11 110.262 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 14.4 ttmm -89.09 -17.33 29.49 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.565 -0.454 . . . . 2.54 110.748 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 500' ' ' MET . 28.1 mm -60.87 -40.39 85.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.324 -0.621 . . . . 1.75 109.324 170.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.603 -0.726 . . . . 2.19 110.603 176.434 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 120.768 0.318 . . . . 2.7 111.749 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 467' ' ' ILE . 77.8 t -64.85 -55.26 21.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.711 0.291 . . . . 1.5 110.441 176.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.712 HD11 HD21 ' A' ' 501' ' ' LEU . 0.0 OUTLIER -66.77 -30.59 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.472 -0.566 . . . . 2.72 109.472 178.623 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 1.037 ' HG3' ' HG3' ' A' ' 482' ' ' MET . 47.5 ttp180 -57.32 -43.6 83.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.858 -0.61 . . . . 3.37 110.096 175.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 469' ' ' LYS . 27.5 t -68.29 -40.97 81.6 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.795 -0.639 . . . . 1.63 110.307 177.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 463' ' ' VAL . 51.6 mm -56.42 -59.29 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 CA-C-N 116.015 -0.538 . . . . 1.59 111.093 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 469' ' ' LYS . 2.8 pp -62.57 -41.23 91.29 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 C-N-CA 120.611 -0.436 . . . . 1.65 111.553 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 468' ' ' ILE . 0.2 OUTLIER -62.75 -38.72 91.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.051 -0.352 . . . . 2.97 110.051 -175.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 67.3 m -94.56 -1.09 53.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.843 -0.617 . . . . 2.1 112.287 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.462 ' OG ' ' HA ' ' A' ' 468' ' ' ILE . 94.0 p -91.86 159.99 15.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.405 -0.518 . . . . 3.4 110.056 175.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . 0.494 ' H ' ' HD2' ' A' ' 472' ' ' ARG . 0.0 OUTLIER -77.34 41.65 0.32 Allowed 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.848 0.832 . . . . 5.5 110.558 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.688 HD23 ' HB3' ' A' ' 478' ' ' LYS . 57.2 tp -91.55 145.38 24.66 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.547 -0.751 . . . . 2.32 109.447 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.562 ' OE1' HD12 ' A' ' 473' ' ' LEU . 1.1 pm0 -52.0 135.01 31.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.431 -0.804 . . . . 3.47 112.262 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.454 ' HA ' ' HE2' ' A' ' 478' ' ' LYS . 7.7 mm-40 -49.49 -65.02 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.168 0.803 . . . . 2.79 113.168 -172.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.38 -40.13 93.2 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.908 -0.317 . . . . 2.63 111.206 -172.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 481' ' ' LEU . 0.0 OUTLIER -54.66 -52.73 61.41 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.683 0.278 . . . . 2.98 111.209 175.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.688 ' HB3' HD23 ' A' ' 473' ' ' LEU . 63.5 pttt -71.97 -36.16 69.74 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.734 -0.386 . . . . 2.3 111.37 -175.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -65.39 -39.59 92.4 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 4.14 110.588 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -63.37 -52.0 63.52 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.576 -0.738 . . . . 2.93 110.018 176.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 485' ' ' LEU . 90.7 mt -66.2 -24.45 66.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.763 -0.653 . . . . 2.73 110.867 179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 1.037 ' HG3' ' HG3' ' A' ' 465' ' ' ARG . 57.5 ttp -68.54 -54.7 15.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.577 -0.283 . . . . 4.93 110.299 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 14.9 t -66.24 -26.63 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 2.46 110.954 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 58.0 mt -83.94 -60.95 1.95 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.433 -0.349 . . . . 2.28 111.905 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.898 ' HA ' HG12 ' A' ' 488' ' ' ILE . 11.2 mp -66.97 -33.5 75.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.359 0.503 . . . . 3.19 112.359 -170.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -66.26 -12.25 55.18 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.395 -0.522 . . . . 3.86 110.207 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.55 -2.14 12.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.125 -0.489 . . . . 2.77 110.776 177.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.898 HG12 ' HA ' ' A' ' 485' ' ' LEU . 19.6 mm -62.63 116.27 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 N-CA-C 109.896 -0.409 . . . . 2.27 109.896 176.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 489' ' ' LYS . 12.0 mmmm -88.66 47.52 1.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.464 0.649 . . . . 5.28 110.534 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . -151.15 84.6 0.16 Allowed Glycine 0 N--CA 1.445 -0.746 0 CA-C-N 115.057 -0.974 . . . . 0.96 110.989 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -52.58 -44.97 66.26 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.34 0.496 . . . . 1.22 112.34 -173.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -60.37 -45.39 93.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.324 0.583 . . . . 2.38 110.789 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -73.08 -39.36 65.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 1.97 111.344 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.436 HD12 ' N ' ' A' ' 495' ' ' ALA . 4.6 pp -72.77 -26.29 61.49 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.227 -0.286 . . . . 1.77 110.227 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.436 ' N ' HD12 ' A' ' 494' ' ' LEU . . . -66.57 -40.85 89.17 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.421 -0.585 . . . . 0.68 109.421 173.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 496' ' ' LYS . 1.1 tmmt? -68.6 -37.72 80.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.618 -0.719 . . . . 2.98 109.919 175.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 497' ' ' PHE . 0.2 OUTLIER -64.7 -32.04 73.54 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.588 0.708 . . . . 1.82 109.693 177.223 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -69.7 -52.77 22.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.143 -0.935 . . . . 1.85 109.417 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -58.85 -34.63 71.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.63 109.061 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.72 ' O ' ' HG2' ' A' ' 503' ' ' LYS . 16.2 tpt -61.61 -59.23 5.52 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.896 -1.047 . . . . 2.52 111.367 -177.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.712 HD21 HD11 ' A' ' 464' ' ' ILE . 3.4 pp -71.59 -26.96 62.81 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.241 -0.584 . . . . 2.09 112.258 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.454 ' N ' HD12 ' A' ' 501' ' ' LEU . 10.7 p -73.71 -34.1 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 119.715 -0.794 . . . . 1.11 110.516 178.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 500' ' ' MET . 19.8 ptmt -76.22 -25.15 54.79 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.779 -0.452 . . . . 2.54 109.779 175.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 500' ' ' MET . 63.6 mt -70.29 -50.43 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-N 116.221 -0.445 . . . . 1.75 111.14 175.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.514 -0.312 . . . . 2.19 111.832 -174.572 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 113.813 1.042 . . . . 2.7 113.813 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 467' ' ' ILE . 38.5 t -58.31 -63.32 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.583 0.216 . . . . 1.5 111.583 -176.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . 0.483 ' HB ' ' CE1' ' A' ' 498' ' ' HIS . 13.3 tt -66.73 -37.33 79.28 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-O 120.688 0.28 . . . . 2.72 110.482 -176.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -56.12 -51.53 67.59 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.659 -0.701 . . . . 3.37 111.042 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 34.8 p -69.57 -40.65 76.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.619 -0.264 . . . . 1.63 111.011 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 463' ' ' VAL . 25.8 mm -55.25 -62.48 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.359 -0.382 . . . . 1.59 111.411 -177.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ILE . . . . . 0.555 HD11 HD23 ' A' ' 485' ' ' LEU . 22.9 pt -65.89 -43.02 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.025 -1.07 . . . . 1.65 110.656 -176.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -51.31 -39.31 56.63 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.664 0.603 . . . . 2.97 111.965 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 37.3 p -90.27 -18.3 25.87 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.786 0.291 . . . . 2.1 111.786 -179.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 70.6 m -63.9 119.33 9.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.25 0.548 . . . . 3.4 111.878 -177.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' ARG . . . . . 0.504 ' HD3' ' HA ' ' A' ' 472' ' ' ARG . 16.8 mmt180 -98.98 9.54 43.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.924 -0.58 . . . . 5.5 111.734 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.759 HD23 ' H ' ' A' ' 473' ' ' LEU . 1.1 pt? -85.1 -44.5 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.58 0.705 . . . . 2.32 109.204 171.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.763 ' HB3' ' CB ' ' A' ' 477' ' ' ARG . 15.1 mm-40 -110.3 89.19 2.95 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.982 -1.008 . . . . 3.47 109.549 -177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.738 ' O ' ' HG2' ' A' ' 478' ' ' LYS . 33.6 tt0 -82.71 -65.17 1.04 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.754 -0.378 . . . . 2.79 111.261 -175.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.65 -30.63 71.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.909 -0.775 . . . . 2.63 108.909 175.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' ARG . . . . . 0.763 ' CB ' ' HB3' ' A' ' 474' ' ' GLU . 0.0 OUTLIER -63.08 -50.34 70.94 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-N 115.431 -0.804 . . . . 2.98 111.21 176.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.738 ' HG2' ' O ' ' A' ' 475' ' ' GLU . 20.1 pttp -58.82 -40.12 83.2 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.174 -0.611 . . . . 2.3 110.894 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -60.97 -53.02 62.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.273 0.558 . . . . 4.14 110.694 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' TYR . . . . . 0.502 ' O ' ' HG ' ' A' ' 484' ' ' LEU . 34.0 t80 -64.79 -44.91 88.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.332 -0.849 . . . . 2.93 111.127 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 477' ' ' ARG . 1.1 tt -74.94 -23.98 58.41 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 115.592 -0.731 . . . . 2.73 110.991 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' MET . . . . . 0.621 ' HA ' HD23 ' A' ' 485' ' ' LEU . 27.7 ttt -75.65 -37.64 59.49 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.367 -0.605 . . . . 4.93 109.367 174.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 18.6 m -61.91 -31.93 72.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.524 0.678 . . . . 2.46 109.272 172.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 480' ' ' TYR . 74.8 mt -77.2 -48.36 17.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.953 -1.021 . . . . 2.28 111.996 177.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 482' ' ' MET . 1.3 pp -62.54 -38.38 89.78 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.172 0.442 . . . . 3.19 109.955 -175.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.96 -26.36 35.98 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.221 -0.899 . . . . 3.86 110.931 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -99.49 -15.26 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.064 -0.516 . . . . 2.77 110.957 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 484' ' ' LEU . 39.4 mm -70.97 -51.69 33.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 109.623 -0.51 . . . . 2.27 109.623 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 63.5 mttm 71.73 -45.55 0.62 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.253 0.971 . . . . 5.28 113.518 168.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . 0.469 ' O ' ' HG ' ' A' ' 494' ' ' LEU . . . -60.83 132.85 49.52 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.422 -0.418 . . . . 0.96 112.427 -177.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' ALA . . . . . . . . . . . . . . . -63.25 -50.33 70.58 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.606 0.225 . . . . 1.22 111.606 -175.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -68.76 -29.52 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.726 0.298 . . . . 2.38 110.976 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -68.09 -44.62 75.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.327 0.584 . . . . 1.97 109.901 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 490' ' ' GLY . 96.9 mt -60.71 -42.52 97.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 1.77 110.116 176.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.623 ' O ' ' HB2' ' A' ' 498' ' ' HIS . . . -62.21 -34.51 76.62 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.195 0.521 . . . . 0.68 110.934 178.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 500' ' ' MET . 3.2 tmtm? -59.61 -49.84 76.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.733 -0.839 . . . . 2.98 108.733 173.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' PHE . . . . . 0.575 ' O ' ' HG ' ' A' ' 501' ' ' LEU . 61.7 m-85 -66.81 -18.41 65.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.917 -0.583 . . . . 1.82 111.648 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' HIS . . . . . 0.623 ' HB2' ' O ' ' A' ' 495' ' ' ALA . 1.7 m80 -65.02 -61.39 2.18 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.39 -0.967 . . . . 1.85 108.39 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . 0.726 ' HG3' ' HE2' ' A' ' 503' ' ' LYS . 6.2 tp60 -61.81 -29.14 69.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.125 -1.398 . . . . 2.63 109.988 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' ' 497' ' ' PHE . 75.7 mmm -57.91 -54.8 42.87 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.083 -0.508 . . . . 2.52 111.046 176.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 497' ' ' PHE . 12.9 mt -65.31 -34.3 78.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.767 0.317 . . . . 2.09 110.612 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 498' ' ' HIS . 84.9 t -62.66 -32.54 55.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 1.11 110.484 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.726 ' HE2' ' HG3' ' A' ' 499' ' ' GLN . 67.9 mttm -81.87 -21.58 37.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.84 0.352 . . . . 2.54 110.938 175.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 500' ' ' MET . 72.9 mt -73.44 -39.17 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 1.75 110.914 175.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 2.19 111.016 -178.226 . . . . . . . . 0 0 . 1 stop_ save_